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86862-60-4 | Carbamic acid, cyclohexenyl-, butyl ester
CAS No: 86862-60-4 Catalog No: AG004M70 MDL No:
Product Description
Catalog Number:
AG004M70
Chemical Name:
Carbamic acid, cyclohexenyl-, butyl ester
CAS Number:
86862-60-4
Molecular Formula:
C11H19NO2
Molecular Weight:
197.2741
IUPAC Name:
butyl N-(cyclohexen-1-yl)carbamate
InChI:
InChI=1S/C11H19NO2/c1-2-3-9-14-11(13)12-10-7-5-4-6-8-10/h7H,2-6,8-9H2,1H3,(H,12,13)
InChI Key:
WUPJLXJTGIYUQL-UHFFFAOYSA-N
SMILES:
CCCCOC(=O)NC1=CCCCC1
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.142g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.278g/mol
Monoisotopic Mass:
197.142g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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