Home Carboxys 4-cyclopropaneamidocyclohexane-1-carboxylic acid, Mixture of isomers

4-cyclopropaneamidocyclohexane-1-carboxylic acid, Mixture of isomers

CAS No.:
1184684-27-2
Catalog Number:
AG01BFNM
Molecular Formula:
C11H17NO3
Molecular Weight:
211.2576
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Product Description
Catalog Number:
AG01BFNM
Chemical Name:
4-cyclopropaneamidocyclohexane-1-carboxylic acid, Mixture of isomers
CAS Number:
1184684-27-2
Molecular Formula:
C11H17NO3
Molecular Weight:
211.2576
MDL Number:
MFCD12156974
IUPAC Name:
4-(cyclopropanecarbonylamino)cyclohexane-1-carboxylic acid
InChI:
InChI=1S/C11H17NO3/c13-10(7-1-2-7)12-9-5-3-8(4-6-9)11(14)15/h7-9H,1-6H2,(H,12,13)(H,14,15)
InChI Key:
XPLDBTPGLAZMTR-UHFFFAOYSA-N
SMILES:
O=C(C1CC1)NC1CCC(CC1)C(=O)O
Properties
Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.121g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
211.261g/mol
Monoisotopic Mass:
211.121g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties