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34970-18-8 | 3,3-Dimethylcyclobutanecarboxylic acid
CAS No: 34970-18-8 Catalog No: AG00381P MDL No:MFCD01734205
Product Description
Catalog Number:
AG00381P
Chemical Name:
3,3-Dimethylcyclobutanecarboxylic acid
CAS Number:
34970-18-8
Molecular Formula:
C7H12O2
Molecular Weight:
128.1690
MDL Number:
MFCD01734205
IUPAC Name:
3,3-dimethylcyclobutane-1-carboxylic acid
InChI:
InChI=1S/C7H12O2/c1-7(2)3-5(4-7)6(8)9/h5H,3-4H2,1-2H3,(H,8,9)
InChI Key:
UWOAWSLEKWLDNR-UHFFFAOYSA-N
SMILES:
OC(=O)C1CC(C1)(C)C
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.084g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
128.171g/mol
Monoisotopic Mass:
128.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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