Home Other Building Blocks 1,3,3-TRIMETHYLCYCLOBUTANE-1-CARBOXYLIC ACID

1,3,3-TRIMETHYLCYCLOBUTANE-1-CARBOXYLIC ACID

CAS No.:
1526786-93-5
Catalog Number:
AG01DTER
Molecular Formula:
C8H14O2
Molecular Weight:
142.1956
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Product Description
Catalog Number:
AG01DTER
Chemical Name:
1,3,3-TRIMETHYLCYCLOBUTANE-1-CARBOXYLIC ACID
CAS Number:
1526786-93-5
Molecular Formula:
C8H14O2
Molecular Weight:
142.1956
MDL Number:
MFCD26598847
IUPAC Name:
1,3,3-trimethylcyclobutane-1-carboxylic acid
InChI:
InChI=1S/C8H14O2/c1-7(2)4-8(3,5-7)6(9)10/h4-5H2,1-3H3,(H,9,10)
InChI Key:
JJSSRNZADBBEEV-UHFFFAOYSA-N
SMILES:
OC(=O)C1(C)CC(C1)(C)C
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.099g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
142.198g/mol
Monoisotopic Mass:
142.099g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties