1-(3-Chloropropyl)-4-methylpiperazine

Modify Date: 2026-07-01 14:43:22

1-(3-Chloropropyl)-4-methylpiperazine structure	Common Name	1-(3-Chloropropyl)-4-methylpiperazine
	CAS Number	104-16-5	Molecular Weight	176.687
	Density	1.0±0.1 g/cm3	Boiling Point	242.9±25.0 °C at 760 mmHg
	Molecular Formula	C₈H₁₇ClN₂	Melting Point	N/A
	MSDS	N/A	Flash Point	100.7±23.2 °C

This table lists Chinese names, IUPAC names and various aliases of this chemical substance.

Name	1-(3-Chloropropyl)-4-methylpiperazine
Synonym	More Synonyms

This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.

Density	1.0±0.1 g/cm3
Boiling Point	242.9±25.0 °C at 760 mmHg
Molecular Formula	C₈H₁₇ClN₂
Molecular Weight	176.687
Flash Point	100.7±23.2 °C
Exact Mass	176.108032
PSA	6.48000
LogP	0.38
Vapour Pressure	0.0±0.5 mmHg at 25°C
Index of Refraction	1.476
InChIKey	AUERUDPETOKUPT-UHFFFAOYSA-N
SMILES	CN1CCN(CCCCl)CC1
Storage condition	-20°C

This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.

CHEMICAL IDENTIFICATION

RTECS NUMBER :: TL3145000

CHEMICAL NAME :: Piperazine, 1-(3-chloropropyl)-4-methyl-

CAS REGISTRY NUMBER :: 104-16-5

BEILSTEIN REFERENCE NO. :: 0106074

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C8-H17-Cl-N2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 104 mg/kg

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

REFERENCE :: APPHAX Acta Poloniae Pharmaceutica. For English translation, see APPFAR. (Ars Polona, POB 1001, 00-680 Warsaw 1, Poland) V.1- 1937- Volume(issue)/page/year: 33,169,1976

This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.

HS Code	2933599090

This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.

methylpiperazine

CAS#:109-01-3

1-Bromo-3-chlor...

CAS#:109-70-6

~78%

1-(3-Chloroprop...

CAS#:104-16-5

Learn More

Literature: Mahesh; Venkatesha Perumal; Pandi Pharmazie, 2005 , vol. 60, # 6 p. 411 - 414

This table lists upstream starting materials and downstream derivative products related to this chemical.

Precursor 2
CAS#:109-01-3 methylpiperazine CAS#:109-70-6 1-Bromo-3-chlor...
DownStream 5
CAS#:1053-74-3 2-Acetyl-10-[3-... CAS#:52172-19-7 7-Hydroxy Proch... CAS#:84-97-9 perazine CAS#:54241-02-0 8-chloro-10-[3-...
CAS#:62040-85-1 Piperazine, 1-(...

This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.

HS Code	2933599090
Summary	2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.

1-(3-Chloropropyl)-4-methylpiperazine

EINECS 203-181-6

This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.

Q: What is the molecular weight of 1-(3-Chloropropyl)-4-methylpiperazine?

A: Molecular weight of 1-(3-Chloropropyl)-4-methylpiperazine is 176.687.

Q: What is the polar surface area (PSA) of 1-(3-Chloropropyl)-4-methylpiperazine?

A: Polar surface area (PSA) of 1-(3-Chloropropyl)-4-methylpiperazine is 6.48000.

Q: What is the English name of 1-(3-Chloropropyl)-4-methylpiperazine?

A: The English name of 1-(3-Chloropropyl)-4-methylpiperazine is 1-(3-Chloropropyl)-4-methylpiperazine.

Q: What are the downstream products of 1-(3-Chloropropyl)-4-methylpiperazine?

A: Related downstream products(CAS) of 1-(3-Chloropropyl)-4-methylpiperazine: 1053-74-3;52172-19-7;84-97-9;54241-02-0;62040-85-1.

Q: What are the upstream materials of 1-(3-Chloropropyl)-4-methylpiperazine?

A: Related upstream materials(CAS) of 1-(3-Chloropropyl)-4-methylpiperazine: 109-01-3;109-70-6.

Q: What is the InChIKey of 1-(3-Chloropropyl)-4-methylpiperazine?

A: InChIKey of 1-(3-Chloropropyl)-4-methylpiperazine is AUERUDPETOKUPT-UHFFFAOYSA-N.

Q: What are the storage conditions for 1-(3-Chloropropyl)-4-methylpiperazine?

A: Storage conditions for 1-(3-Chloropropyl)-4-methylpiperazine: -20°C.

Q: What is the CAS number of 1-(3-Chloropropyl)-4-methylpiperazine?

A: CAS number of 1-(3-Chloropropyl)-4-methylpiperazine is 104-16-5.

Q: What is the SMILES notation of 1-(3-Chloropropyl)-4-methylpiperazine?

A: SMILES notation of 1-(3-Chloropropyl)-4-methylpiperazine is CN1CCN(CCCCl)CC1.

Q: What English synonyms does 1-(3-Chloropropyl)-4-methylpiperazine have?

A: English synonyms of 1-(3-Chloropropyl)-4-methylpiperazine: 1-(3-Chloropropyl)-4-methylpiperazine, EINECS 203-181-6.

This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.

Shanghai Nianxing Industrial Co., Ltd

Dayang Chem (Hangzhou) Co., Ltd.

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Shanghai Nianxing Industrial Co., Ltd
China
Product Name: 1-(3-Chloropropyl)-4-methylpiperazine
Price: Check
Purity: 98.0%
Delivery: 10 Day
Contact: Yang
Email: sales@echemcloud.com

Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: 1-(3-chloropropyl)-4-methylpiperazine
Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
Purity: 98.0%
Delivery: Inquiry
Contact: Ms Wang
Email: enquiry@dycnchem.com

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Price: ￥713/1g

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1-(3-Chloropropyl)-4-methylpiperazine

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