Related Searches: 1-(2-methylpropyl)amine, N,N'-diethyl urea, Urea, hydrochloride(1:1), 1-(N,N-dimethylamine), Urea,N-(2-chloroethyl)-N'-cyclohexyl-N-nitroso-, View all

Urea,N-(1-methylpropyl)-(CAS No. 689-11-2)

Urea,N-(1-methylpropyl)- C5H12N2O (cas 689-11-2) Molecular Structure

689-11-2 Structure

Identification and Related Records

【Name】
Urea,N-(1-methylpropyl)-
【CAS Registry number】
689-11-2
【Synonyms】
Urea,(1-methylpropyl)- (9CI)
Urea, sec-butyl- (7CI,8CI)
N-sec-Butylurea
NSC27458
sec-Butylurea
【EINECS(EC#)】
211-709-1
【Molecular Formula】
C5H12 N2 O (Products with the same molecular formula)
【Molecular Weight】
116.16
【Inchi】
InChI=1/C5H12N2O/c1-3-4(2)7-5(6)8/h4H,3H2,1-2H3,(H3,6,7,8)
【InChIKey】
CBRSBDUOPJQVMP-UHFFFAOYSA-N
【Canonical SMILES】
CCC(C)NC(=O)N
【MOL File】
689-11-2.mol

Chemical and Physical Properties

【Density】
0.959g/cm3
【Boiling Point】
171.5°C at 760 mmHg
【Refractive Index】
1.446
【Flash Point】
57.5°C
【Solubilities】
SOL IN ALCOHOL, ETHER
【Computed Properties】
Molecular Weight:116.16158 [g/mol]
Molecular Formula:C5H12N2O
XLogP3-AA:0.3
H-Bond Donor:2
H-Bond Acceptor:1
Rotatable Bond Count:2
Tautomer Count:3
Exact Mass:116.094963
MonoIsotopic Mass:116.094963
Topological Polar Surface Area:55.1
Heavy Atom Count:8
Formal Charge:0
Complexity:82.5
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Donor Count:2
Feature 3D Hydrophobe Count:1
Effective Rotor Count:3
Conformer Sampling RMSD:0.6
CID Conformer Count:11

Safety and Handling

【Safety Statements 】
Moderately toxic by parenteral route. When heated to decomposition it emits toxic vapors of NOx.
【Safety】

Moderately toxic by parenteral route. When heated to decomposition it emits toxic vapors of NOx.

【Report】

Reported in EPA TSCA Inventory.

Supplier Location

Top Suppliers

Diamond member Hangzhou Dayangchem Co., Ltd.
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-571-88938639
Finetech Industry limited.
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-27-87465837
Jinan Haohua Industry Co., Ltd.
Country:ChinaChina
Business Type:Manufacturer
Telephone:0086-531-58773055
Shanghai Meicheng Chemical Co., Ltd.
Country:ChinaChina
Business Type:Distributor/Wholesaler
Telephone:86-21-50677091
Zhejiang Kaili Industrial Co., Ltd.
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-571-85241926
Amadis Chemical Co.,Ltd.
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-571-89925085
Zouping Mingxing Chemical Co.,Ltd.
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-135-15431451
Angene International Limited
Country:Hong kongHong kong
Business Type:Manufacturer
Telephone:852-852-81916999
HEBEI CUI FENG IMPORT&EXPORT TRADE CO.,LTD
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-311-80955068
Beijing Hengrun Weiyuan Biotechnologies,. Inc.
Country:ChinaChina
Business Type:Manufacturer
Telephone:+86-(10)-6969-6397

Quick Search

Cas    Name

Related products