Home Carboxys 4-methylbicyclo[4.1.0]heptane-3-carboxylic acid, Mixture of diastereomers

4-methylbicyclo[4.1.0]heptane-3-carboxylic acid, Mixture of diastereomers

CAS No.:
2138147-10-9
Catalog Number:
AG01EKQ2
Molecular Formula:
C9H14O2
Molecular Weight:
154.2063
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Product Description
Catalog Number:
AG01EKQ2
Chemical Name:
4-methylbicyclo[4.1.0]heptane-3-carboxylic acid, Mixture of diastereomers
CAS Number:
2138147-10-9
Molecular Formula:
C9H14O2
Molecular Weight:
154.2063
MDL Number:
MFCD31453585
IUPAC Name:
4-methylbicyclo[4.1.0]heptane-3-carboxylic acid
InChI:
InChI=1S/C9H14O2/c1-5-2-6-3-7(6)4-8(5)9(10)11/h5-8H,2-4H2,1H3,(H,10,11)
InChI Key:
DNAZUAVTUMONLH-UHFFFAOYSA-N
SMILES:
CC1CC2CC2CC1C(=O)O
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.099g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
154.209g/mol
Monoisotopic Mass:
154.099g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
4  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties