Home Aminos Cyclohexaneacetic acid, 1-[(acetylamino)methyl]-

Cyclohexaneacetic acid, 1-[(acetylamino)methyl]-

CAS No.:
344460-27-1
Catalog Number:
AG01DTAQ
Molecular Formula:
C11H19NO3
Molecular Weight:
213.2735
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Product Description
Catalog Number:
AG01DTAQ
Chemical Name:
Cyclohexaneacetic acid, 1-[(acetylamino)methyl]-
CAS Number:
344460-27-1
Molecular Formula:
C11H19NO3
Molecular Weight:
213.2735
MDL Number:
MFCD16154754
IUPAC Name:
2-[1-(acetamidomethyl)cyclohexyl]acetic acid
InChI:
InChI=1S/C11H19NO3/c1-9(13)12-8-11(7-10(14)15)5-3-2-4-6-11/h2-8H2,1H3,(H,12,13)(H,14,15)
InChI Key:
FNUJAQMRFKOBKB-UHFFFAOYSA-N
SMILES:
CC(=O)NCC1(CCCCC1)CC(=O)O
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.136g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
213.277g/mol
Monoisotopic Mass:
213.136g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties