Home Other Building Blocks 2-(cyclopentylmethyl)butanoic acid

2-(cyclopentylmethyl)butanoic acid

CAS No.:
14276-86-9
Catalog Number:
AG01AIDS
Molecular Formula:
C10H18O2
Molecular Weight:
170.2487
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Product Description
Catalog Number:
AG01AIDS
Chemical Name:
2-(cyclopentylmethyl)butanoic acid
CAS Number:
14276-86-9
Molecular Formula:
C10H18O2
Molecular Weight:
170.2487
MDL Number:
MFCD14694965
IUPAC Name:
2-(cyclopentylmethyl)butanoic acid
InChI:
InChI=1S/C10H18O2/c1-2-9(10(11)12)7-8-5-3-4-6-8/h8-9H,2-7H2,1H3,(H,11,12)
InChI Key:
BWANPEYEQQDRFW-UHFFFAOYSA-N
SMILES:
CCC(C(=O)O)CC1CCCC1
Properties
Complexity:
148  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.131g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.252g/mol
Monoisotopic Mass:
170.131g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties