Home Carboxys 1-hydroxy-3,3-dimethylcyclobutane-1-carboxylic acid

1-hydroxy-3,3-dimethylcyclobutane-1-carboxylic acid

CAS No.:
855382-31-9
Catalog Number:
AG01DWQ0
Molecular Formula:
C7H12O3
Molecular Weight:
144.1684
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Product Description
Catalog Number:
AG01DWQ0
Chemical Name:
1-hydroxy-3,3-dimethylcyclobutane-1-carboxylic acid
CAS Number:
855382-31-9
Molecular Formula:
C7H12O3
Molecular Weight:
144.1684
MDL Number:
MFCD19230616
IUPAC Name:
1-hydroxy-3,3-dimethylcyclobutane-1-carboxylic acid
InChI:
InChI=1S/C7H12O3/c1-6(2)3-7(10,4-6)5(8)9/h10H,3-4H2,1-2H3,(H,8,9)
InChI Key:
AYVWOXFLVDZWOH-UHFFFAOYSA-N
SMILES:
OC(=O)C1(O)CC(C1)(C)C
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.079g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
144.17g/mol
Monoisotopic Mass:
144.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties