Home Other Building Blocks 1,3-DIMETHYL-CYCLOBUTANECARBOXYLIC ACID

1,3-DIMETHYL-CYCLOBUTANECARBOXYLIC ACID

CAS No.:
806615-12-3
Catalog Number:
AG01DWOF
Molecular Formula:
C7H12O2
Molecular Weight:
128.1690
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Product Description
Catalog Number:
AG01DWOF
Chemical Name:
1,3-DIMETHYL-CYCLOBUTANECARBOXYLIC ACID
CAS Number:
806615-12-3
Molecular Formula:
C7H12O2
Molecular Weight:
128.1690
MDL Number:
MFCD26381345
IUPAC Name:
1,3-dimethylcyclobutane-1-carboxylic acid
InChI:
InChI=1S/C7H12O2/c1-5-3-7(2,4-5)6(8)9/h5H,3-4H2,1-2H3,(H,8,9)
InChI Key:
BUHKJHMRUNVSED-UHFFFAOYSA-N
SMILES:
CC1CC(C1)(C)C(=O)O
Properties
Complexity:
134  
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  
Properties