Home Other Building Blocks 3-cyclopropyl-3-hydroxy-3-phenylpropanoic acid

3-cyclopropyl-3-hydroxy-3-phenylpropanoic acid

CAS No.:
95769-79-2
Catalog Number:
AG01AK83
Molecular Formula:
C12H14O3
Molecular Weight:
206.2378
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Product Description
Catalog Number:
AG01AK83
Chemical Name:
3-cyclopropyl-3-hydroxy-3-phenylpropanoic acid
CAS Number:
95769-79-2
Molecular Formula:
C12H14O3
Molecular Weight:
206.2378
MDL Number:
MFCD11936034
IUPAC Name:
3-cyclopropyl-3-hydroxy-3-phenylpropanoic acid
InChI:
InChI=1S/C12H14O3/c13-11(14)8-12(15,10-6-7-10)9-4-2-1-3-5-9/h1-5,10,15H,6-8H2,(H,13,14)
InChI Key:
UZPRCDDDTTZRRE-UHFFFAOYSA-N
SMILES:
OC(=O)CC(c1ccccc1)(C1CC1)O
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.094g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
206.241g/mol
Monoisotopic Mass:
206.094g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties