Phenyl isothiocyanate

Modify Date: 2025-08-23 16:52:36

Phenyl isothiocyanate structure	Common Name	Phenyl isothiocyanate
	CAS Number	103-72-0	Molecular Weight	135.186
	Density	1.0±0.1 g/cm3	Boiling Point	221.0±9.0 °C at 760 mmHg
	Molecular Formula	C₇H₅NS	Melting Point	−21 °C(lit.)
	MSDS	Chinese USA	Flash Point	87.8±0.0 °C
	Symbol	GHS05, GHS06, GHS08	Signal Word	Danger

Name	phenyl isothiocyanate
Synonym	More Synonyms

Density	1.0±0.1 g/cm3
Boiling Point	221.0±9.0 °C at 760 mmHg
Melting Point	−21 °C(lit.)
Molecular Formula	C₇H₅NS
Molecular Weight	135.186
Flash Point	87.8±0.0 °C
Exact Mass	135.014267
PSA	44.45000
LogP	3.24
Vapour Pressure	0.2±0.4 mmHg at 25°C
Index of Refraction	1.571
Stability	Stable. Combustible. Incompatible with strong oxidizing agents, strong acids.

Phenyl isothiocyanate MSDS(Chinese)

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NX9275000

CHEMICAL NAME :: Isothiocyanic acid, phenyl ester

CAS REGISTRY NUMBER :: 103-72-0

BEILSTEIN REFERENCE NO. :: 0471392

LAST UPDATED :: 199710

DATA ITEMS CITED :: 11

MOLECULAR FORMULA :: C7-H5-N-S

MOLECULAR WEIGHT :: 135.19

WISWESSER LINE NOTATION :: SCNR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 150 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 87 mg/kg

TOXIC EFFECTS :: Kidney, Ureter, Bladder - urine volume increased

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 100 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 250 mg/kg

TOXIC EFFECTS :: Behavioral - convulsions or effect on seizure threshold

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Subcutaneous

DOSE :: 225 mg/kg

SEX/DURATION :: female 6-14 day(s) after conception

TOXIC EFFECTS :: Reproductive - Specific Developmental Abnormalities - Central Nervous System Reproductive - Specific Developmental Abnormalities - eye/ear Reproductive - Specific Developmental Abnormalities - craniofacial (including nose and tongue)

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Subcutaneous

DOSE :: 225 mg/kg

SEX/DURATION :: female 6-14 day(s) after conception

TOXIC EFFECTS :: Reproductive - Effects on Embryo or Fetus - extra-embryonic structures (e.g., placenta, umbilical cord) Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death, e.g., stunted fetus)

TYPE OF TEST :: Mutation test systems - not otherwise specified

MUTATION DATA

TEST SYSTEM :: Mammal - species unspecified

DOSE/DURATION :: 800 ug/L

REFERENCE :: MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 300,111,1993 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 83829 No. of Facilities: 21 (estimated) No. of Industries: 1 No. of Occupations: 2 No. of Employees: 166 (estimated)

Symbol	GHS05, GHS06, GHS08
Signal Word	Danger
Hazard Statements	H301-H314-H317-H334
Precautionary Statements	P261-P280-P301 + P310-P305 + P351 + P338-P310
Personal Protective Equipment	Faceshields;full-face respirator (US);Gloves;Goggles;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes	T:Toxic;N:Dangerousfortheenvironment;
Risk Phrases	R23/24/25;R34;R42/43;R63
Safety Phrases	S9-S16-S29-S33-S60-S61-S62-S36-S26-S23-S45-S36/37/39
RIDADR	UN 1993 3/PG 2
WGK Germany	3
RTECS	NX9275000
Packaging Group	II
Hazard Class	6.1
HS Code	2930909090

Precursor 9
CAS#:75-15-0 Carbon disulphide CAS#:463-71-8 Thiophosgene CAS#:43009-16-1 PhNHCSS-*Et3NH+ CAS#:698-16-8 Alpha-Chloroben...
CAS#:102-08-9 Thiocarbanilide CAS#:1074-52-8 Carbamodithioic... CAS#:93-98-1 Benzanilide CAS#:404-24-0 Trifluoroacetanilide
CAS#:103-70-8 Formamide, N-phenyl-
DownStream 10
CAS#:109322-16-9 1-[[2-(9-bromoi... CAS#:109322-11-4 1-[[2-(2-chloro... CAS#:109322-26-1 3-[(9-bromoindo... CAS#:109768-66-3 (4-FORMYL-2-MET...
CAS#:111782-17-3 1-phenyl-3-tetr... CAS#:105202-01-5 N-phenyl-5-(tri... CAS#:111931-61-4 N-(1,3-benzothi... CAS#:109322-21-6 3-[(2-chloroind...
CAS#:107427-77-0 3-anilino-2-cya... CAS#:112107-41-2 3-phenylpyrido[...

HS Code	2930909090
Summary	2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Allyl isothiocyanate induces replication-associated DNA damage response in NSCLC cells and sensitizes to ionizing radiation.

Oncotarget 6(7) , 5237-52, (2015)

Allyl isothiocyanate (AITC), a constituent of many cruciferous vegetables exhibits significant anticancer activities in many cancer models. Our studies provide novel insights into AITC-induced antican...

Developing structure-activity relationships for the prediction of hepatotoxicity.

Chem. Res. Toxicol. 23 , 1215-22, (2010)

Drug-induced liver injury is a major issue of concern and has led to the withdrawal of a significant number of marketed drugs. An understanding of structure-activity relationships (SARs) of chemicals ...

A predictive ligand-based Bayesian model for human drug-induced liver injury.

Drug Metab. Dispos. 38 , 2302-8, (2010)

Drug-induced liver injury (DILI) is one of the most important reasons for drug development failure at both preapproval and postapproval stages. There has been increased interest in developing predicti...

Thiocarbanil

isothiocyanic acid phenyl ester

UNII:0D58F84LSU

Benzene, isothiocyanato-

MFCD00004798

Edman Reagent

Isothiocyanatobenzene

Phenyl isothiocyanate

EINECS 203-138-1

benzenisothiocyanate

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.

Shanghai Nianxing Industrial Co., Ltd
China
Product Name: Phenyl isothiocyanate
Price: Check
Purity: 99.0%
Delivery: 10 Day
Contact: Yang
Email: sales@echemcloud.com

Shanghai Jizhi Biochemical Technology Co., Ltd
China
Product Name: Phenyl isothiocyanate
Price: ￥78.0/25g ￥228.0/100g
Purity: 97.0%
Delivery: Inquiry
Contact: Liu jia
Email: 2130147988@qq.com

Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: Phenyl isothiocyanate
Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
Purity: 98.0%
Delivery: Inquiry
Contact: Ms Wang
Email: enquiry@dycnchem.com

Henan Tianfu Chemical Co., Ltd.
China
Product Name: 103-72-0 PHENYL ISOTHIOCYANATE
Price: $Inquiry/1kg $Inquiry/25kg $Inquiry/1000kg $Inquiry/10ton
Purity: 99.0%
Delivery: Inquiry
Contact: Anson
Email: info@tianfuchem.com

Get all suppliers and price by the below link:

Phenyl isothiocyanate suppliers

Phenyl isothiocyanate price

Phenyl isothiocyanate

Names

Chemical & Physical Properties

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

Safety Information

Synthetic Route

Precursor & DownStream

Customs

Articles50

Synonyms

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.