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13908-10-6

13908-10-6 | Cyclopentanecarboxylic acid, 1-[[[(2-chloroethyl)amino]carbonyl]amino]-, ethyl ester

CAS No: 13908-10-6 Catalog No: AG001A6M MDL No:

Product Description

Catalog Number:
AG001A6M
Chemical Name:
Cyclopentanecarboxylic acid, 1-[[[(2-chloroethyl)amino]carbonyl]amino]-, ethyl ester
CAS Number:
13908-10-6
Molecular Formula:
C11H19ClN2O3
Molecular Weight:
262.7332
IUPAC Name:
ethyl 1-(2-chloroethylcarbamoylamino)cyclopentane-1-carboxylate
InChI:
InChI=1S/C11H19ClN2O3/c1-2-17-9(15)11(5-3-4-6-11)14-10(16)13-8-7-12/h2-8H2,1H3,(H2,13,14,16)
InChI Key:
QWGPMPXWQYWXRD-UHFFFAOYSA-N
SMILES:
ClCCNC(=O)NC1(CCCC1)C(=O)OCC
NSC Number:
99432

Properties

Complexity:
278  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.108g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
262.734g/mol
Monoisotopic Mass:
262.108g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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