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13670-26-3

13670-26-3 | Carbamic acid, (2-chloroethyl)propionyl-, ethyl ester (8CI)

CAS No: 13670-26-3 Catalog No: AG00128W MDL No:

Product Description

Catalog Number:
AG00128W
Chemical Name:
Carbamic acid, (2-chloroethyl)propionyl-, ethyl ester (8CI)
CAS Number:
13670-26-3
Molecular Formula:
C8H14ClNO3
Molecular Weight:
207.6547
IUPAC Name:
ethyl N-(2-chloroethyl)-N-propanoylcarbamate
InChI:
InChI=1S/C8H14ClNO3/c1-3-7(11)10(6-5-9)8(12)13-4-2/h3-6H2,1-2H3
InChI Key:
AAYIGPHEBPHEIF-UHFFFAOYSA-N
SMILES:
ClCCCCC(=O)NC(=O)OCC
NSC Number:
157466

Properties

Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.066g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.654g/mol
Monoisotopic Mass:
207.066g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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