isopentyl-ure

Modify Date: 2025-11-03 17:53:50

isopentyl-ure Structure
isopentyl-ure structure
Common Name isopentyl-ure
CAS Number 628-49-9 Molecular Weight 130.18800
Density 0.946g/cm3 Boiling Point 192.8ºC at 760 mmHg
Molecular Formula C6H14N2O Melting Point N/A
MSDS N/A Flash Point 70.4ºC

 Names

Name 1-(3-Methylbutyl)ure
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.946g/cm3
Boiling Point 192.8ºC at 760 mmHg
Molecular Formula C6H14N2O
Molecular Weight 130.18800
Flash Point 70.4ºC
Exact Mass 130.11100
PSA 56.11000
LogP 1.60550
Index of Refraction 1.449
InChIKey LLRPMCWEGQFYFB-UHFFFAOYSA-N
SMILES CC(C)CCNC(N)=O

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YT5425000
CHEMICAL NAME :
Urea, isopentyl-
CAS REGISTRY NUMBER :
628-49-9
BEILSTEIN REFERENCE NO. :
1748975
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C6-H14-N2-O
MOLECULAR WEIGHT :
130.22
WISWESSER LINE NOTATION :
ZVM2Y1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Parenteral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
912 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 2924199090

 Synthetic Route

 Customs

HS Code 2924199090
Summary 2924199090. other acyclic amides (including acyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Synonyms

1H-Pyrrole-2-carboxaldehyde,1-(3-methylbutyl)
N-Isopentyl-harnstoff
1-isopentyl-pyrrole-2-carbaldehyde
1-Isoamyl-2-formyl-pyrrol
1-(3-methylbutyl)-1H-pyrrole-2-carbaldehyde
Isopentyl-harnstoff
1-(3-methyl-butyl)-pyrrole-2-carbaldehyde
(3-methylbutyl)-urea
N-Isoamyl-harnstoff
1-isopentylurea
isopentyl-urea
1-Isopentyl-pyrrol-2-carbaldehyd
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