Home Other Building Blocks 2-(4-pentylidenecyclohexyl)acetic acid

2-(4-pentylidenecyclohexyl)acetic acid

CAS No.:
1803599-25-8
Catalog Number:
AG01BAZS
Molecular Formula:
C13H22O2
Molecular Weight:
210.3126
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Product Description
Catalog Number:
AG01BAZS
Chemical Name:
2-(4-pentylidenecyclohexyl)acetic acid
CAS Number:
1803599-25-8
Molecular Formula:
C13H22O2
Molecular Weight:
210.3126
MDL Number:
MFCD28505827
IUPAC Name:
2-(4-pentylidenecyclohexyl)acetic acid
InChI:
InChI=1S/C13H22O2/c1-2-3-4-5-11-6-8-12(9-7-11)10-13(14)15/h5,12H,2-4,6-10H2,1H3,(H,14,15)
InChI Key:
ILQVXSSEKMCHDO-UHFFFAOYSA-N
SMILES:
CCCC/C=C/1\CCC(CC1)CC(=O)O
Properties
Complexity:
221  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.162g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
210.317g/mol
Monoisotopic Mass:
210.162g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties