N-sec-Butylurea

Modify Date: 2025-08-31 15:52:00

N-sec-Butylurea Structure
N-sec-Butylurea structure
Common Name N-sec-Butylurea
CAS Number 689-11-2 Molecular Weight 116.16200
Density 0.959g/cm3 Boiling Point 171.5ºC at 760 mmHg
Molecular Formula C5H12N2O Melting Point N/A
MSDS N/A Flash Point 57.5ºC

 Names

Name N-sec-Butylurea
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.959g/cm3
Boiling Point 171.5ºC at 760 mmHg
Molecular Formula C5H12N2O
Molecular Weight 116.16200
Flash Point 57.5ºC
Exact Mass 116.09500
PSA 55.12000
LogP 1.54440
Index of Refraction 1.446
InChIKey CBRSBDUOPJQVMP-UHFFFAOYSA-N
SMILES CCC(C)NC(N)=O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YS3678000
CHEMICAL NAME :
Urea, sec-butyl-
CAS REGISTRY NUMBER :
689-11-2
LAST UPDATED :
199710
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C5-H12-N2-O
MOLECULAR WEIGHT :
116.19

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
7500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: OTS0571269
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Parenteral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
2789 mg/kg
TOXIC EFFECTS :
Behavioral - general anesthetic Behavioral - somnolence (general depressed activity)
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 52,216,1934

 Safety Information

HS Code 2924299090

 Synthetic Route

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N-sec-Butylurea Structure

N-sec-Butylurea

CAS#:689-11-2

Literature: US2673859 , ;

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N-sec-Butylurea Structure

N-sec-Butylurea

CAS#:689-11-2

Literature: Pharmaceutical Chemistry Journal, , vol. 6, # 7 p. 451 - 453 Khimiko-Farmatsevticheskii Zhurnal, , vol. 6, # 7 p. 29 - 31

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N-sec-Butylurea Structure

N-sec-Butylurea

CAS#:689-11-2

Literature: Archiv der Pharmazie (Weinheim, Germany), , vol. 242, p. 62

 Customs

HS Code 2924299090
Summary 2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Synonyms

butan-2-ylurea
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