Home Other Building Blocks 2-(2,2-dimethyl-1-phenylcyclopropyl)acetic acid

2-(2,2-dimethyl-1-phenylcyclopropyl)acetic acid

CAS No.:
1530904-01-8
Catalog Number:
AG01B6ZG
Molecular Formula:
C13H16O2
Molecular Weight:
204.2649
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Product Description
Catalog Number:
AG01B6ZG
Chemical Name:
2-(2,2-dimethyl-1-phenylcyclopropyl)acetic acid
CAS Number:
1530904-01-8
Molecular Formula:
C13H16O2
Molecular Weight:
204.2649
MDL Number:
MFCD24487167
IUPAC Name:
2-(2,2-dimethyl-1-phenylcyclopropyl)acetic acid
InChI:
InChI=1S/C13H16O2/c1-12(2)9-13(12,8-11(14)15)10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,14,15)
InChI Key:
SEQQWAUDIPDGAC-UHFFFAOYSA-N
SMILES:
OC(=O)CC1(CC1(C)C)c1ccccc1
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.115g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.269g/mol
Monoisotopic Mass:
204.115g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties