Products for Research Use Only
RegisterLogin

2-Phenylcyclopropanecarboxylicacid

CAT: 0013-GTR19259196-01Size: 200 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19259196-01Size:200 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
2-Phenylcyclopropanecarboxylicacid, with CAS No. 5685-38-1, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. 2-Phenylcyclopropanecarboxylicacid provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
CAS Number
5685-38-1
Smiles
OC (=O) C1CC1C1=CC=CC=C1
Molecular Formula
C10H10O2
Molecular Weight
162.188
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2-Phenylcyclopropane-1-carboxylic acid

inhibits 1-aminocyclopropane-1-carboxylic acid oxidase; structure in first source

CAS Number5685-38-1
PubChem CID70323
IUPAC Name2-phenylcyclopropane-1-carboxylic acid
Molecular FormulaC10H10O2
Molecular Weight162.18
XLogP1.6
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity182
SMILES
C1C(C1C(=O)O)C2=CC=CC=C2
InChI
InChI=1S/C10H10O2/c11-10(12)9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6H2,(H,11,12)
InChIKey
AHDDRJBFJBDEPW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Phenylcyclopropane-1-carboxylic acid
CAS: 5685-38-1
CID: 70323
Formula: C10H10O2
MW: 162.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight162.18
XLogP31.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass162.068079557
Monoisotopic Mass162.068079557
Topological Polar Surface Area37.3 Ų
Heavy Atom Count12
Formal Charge0
Complexity182
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
GTR19216509-012,2,2-Trichloroethanol
GTR19255109-012,2,2-Trifluoroacetamide
GTR19170856-012,2,2-Trichloroethanol
GTR19216331-012-[2- (2,2,2-Trifluoroethoxy) phenoxy]ethyl methanesulfonate
GTR19228240-012-[2- (2,2,2-Trifluoroethoxy) phenoxy]ethyl bromide
GTR19166705-012-[2- (2,2,2-Trifluoroethoxy) phenoxy]ethyl methanesulfonate
GTR19243300-012,2-Dibromo-2-cyanoacetamide
GTR19169550-012,2':5',2''-Terthiophene
GTR19254763-012,2':6',2''-Terpyridine
GTR19266996-012,2'-Azobis[2- (2-imidazolin-2-yl) propane] dihydrochloride

Alternative Products

CatalogName
Fr21218-012-Phenylcyclopropanecarboxylicacid
PC1003049-012,2,2-Trifluoroethyl 2,2,2-trichloroacetate
H 038-0052'- , 2''-, 2''', 2'''', 2''''', 2''''''- Hexadeoxy- 2'-, 2'', 2''', 2'''', 2''''', 2''''''- hexafluoro- cyclic hexaadenosine monophosphate (2',2'',2''',2'''',2''''',2''''''-Hexa-F-c-hexadAMP / cFA6), sodium salt
PC32719-012,2,2,2'-Tetrafluoroacetophenone
OR1009873-012,2,2,2-Ethylenedinitrilotetraethanol
290343-012,2,2-Trifluoroethyl 2-hydroxy-5- (2,2,2-trifluoroethoxy) benzoate
AAA407372,2,2-Trifluoro-N- (2,2,2-trifluoroethyl) acetamide
WYB72229-012,2,2-Trifluoroethyl N- (2,2,2-trifluoroethyl) carbamate
BLG-H038-0012′,2”,2”’,2””,2””’,2”””-Hexa-F-c-hexadAMP
IXB41367-01(2,2-Dimethylpropyl) (2,2,2-trifluoroethyl) amine

Popular Products