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15760-36-8 | Cyclobutanecarboxylic acid, 3-methylene-
CAS No: 15760-36-8 Catalog No: AG001PJK MDL No:MFCD00101901
Product Description
Catalog Number:
AG001PJK
Chemical Name:
Cyclobutanecarboxylic acid, 3-methylene-
CAS Number:
15760-36-8
Molecular Formula:
C6H8O2
Molecular Weight:
112.1265
MDL Number:
MFCD00101901
IUPAC Name:
3-methylidenecyclobutane-1-carboxylic acid
InChI:
InChI=1S/C6H8O2/c1-4-2-5(3-4)6(7)8/h5H,1-3H2,(H,7,8)
InChI Key:
NNKLICLIBKMDOY-UHFFFAOYSA-N
SMILES:
OC(=O)C1CC(=C)C1
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
112.052g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
112.128g/mol
Monoisotopic Mass:
112.052g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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