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101269-83-4 | Carbamic acid, (2-chloroethyl)cyclohexyl-, phenylmethyl ester (9CI)
CAS No: 101269-83-4 Catalog No: AG00043N MDL No:
Product Description
Catalog Number:
AG00043N
Chemical Name:
Carbamic acid, (2-chloroethyl)cyclohexyl-, phenylmethyl ester (9CI)
CAS Number:
101269-83-4
Molecular Formula:
C16H22ClNO2
Molecular Weight:
295.8044
IUPAC Name:
benzyl N-(2-chloroethyl)-N-cyclohexylcarbamate
InChI:
InChI=1S/C16H22ClNO2/c17-11-12-18(15-9-5-2-6-10-15)16(19)20-13-14-7-3-1-4-8-14/h1,3-4,7-8,15H,2,5-6,9-13H2
InChI Key:
VWHGKWRJPATRDZ-UHFFFAOYSA-N
SMILES:
ClCCN(C(=O)OCc1ccccc1)C1CCCCC1
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.134g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.807g/mol
Monoisotopic Mass:
295.134g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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