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16001-64-2

16001-64-2 | Carbamic acid, N-(2-chloroacetyl)-, phenylmethyl ester

CAS No: 16001-64-2 Catalog No: AG001RM1 MDL No:MFCD07348581

Product Description

Catalog Number:
AG001RM1
Chemical Name:
Carbamic acid, N-(2-chloroacetyl)-, phenylmethyl ester
CAS Number:
16001-64-2
Molecular Formula:
C10H10ClNO3
Molecular Weight:
227.6443
MDL Number:
MFCD07348581
IUPAC Name:
benzyl N-(2-chloroacetyl)carbamate
InChI:
InChI=1S/C10H10ClNO3/c11-6-9(13)12-10(14)15-7-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,12,13,14)
InChI Key:
PFOQENPGHAIKIH-UHFFFAOYSA-N
SMILES:
ClCC(=O)NC(=O)OCc1ccccc1

Properties

Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.035g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.644g/mol
Monoisotopic Mass:
227.035g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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