Home Other Building Blocks 4-(cyclobutylmethyl)benzoic acid

4-(cyclobutylmethyl)benzoic acid

CAS No.:
37874-96-7
Catalog Number:
AG01BV4T
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
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Product Description
Catalog Number:
AG01BV4T
Chemical Name:
4-(cyclobutylmethyl)benzoic acid
CAS Number:
37874-96-7
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
MDL Number:
MFCD20639088
IUPAC Name:
4-(cyclobutylmethyl)benzoic acid
InChI:
InChI=1S/C12H14O2/c13-12(14)11-6-4-10(5-7-11)8-9-2-1-3-9/h4-7,9H,1-3,8H2,(H,13,14)
InChI Key:
ABJNZQLPTZVNCG-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)CC1CCC1
NSC Number:
172987
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.099g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.242g/mol
Monoisotopic Mass:
190.099g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties