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86467-22-3 | Bicyclo[3.1.0]hexane-6-carboxylic acid, 1-methyl-
CAS No: 86467-22-3 Catalog No: AG004QQA MDL No:
Product Description
Catalog Number:
AG004QQA
Chemical Name:
Bicyclo[3.1.0]hexane-6-carboxylic acid, 1-methyl-
CAS Number:
86467-22-3
Molecular Formula:
C8H12O2
Molecular Weight:
140.1797
IUPAC Name:
1-methylbicyclo[3.1.0]hexane-6-carboxylic acid
InChI:
InChI=1S/C8H12O2/c1-8-4-2-3-5(8)6(8)7(9)10/h5-6H,2-4H2,1H3,(H,9,10)
InChI Key:
YDUSPDJGDMRUQD-UHFFFAOYSA-N
SMILES:
OC(=O)C1C2C1(C)CCC2
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.084g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
140.182g/mol
Monoisotopic Mass:
140.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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