AG006ENV

936727-93-4 | 1-(4-(trifluoromethoxy)phenyl)cyclopropanecarboxylic acid

AG006ENV

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CAS Number	936727-93-4
Catalog Number	AG006ENV(AGN-PC-0WAJ1N)
Chemical Name	1-(4-(trifluoromethoxy)phenyl)cyclopropanecarboxylic acid
IUPAC Name	1-[4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxylic acid
InChI	InChI=1S/C11H9F3O3/c12-11(13,14)17-8-3-1-7(2-4-8)10(5-6-10)9(15)16/h1-4H,5-6H2,(H,15,16)
InChI Key	WLYQHMMKMYCFAP-UHFFFAOYSA-N
MDL Number	MFCD11037007
Molecular Formula	C11H9F3O3
Molecular Weight	246.1826
SMILES	OC(=O)C1(CC1)c1ccc(cc1)OC(F)(F)F
Synonyms	936727-93-4, 1-(4-(trifluoromethoxy)phenyl)cyclopropanecarboxylic acid, 1-[4-(Trifluoromethoxy)phenyl]cyclopropanecarboxylic Acid, J-503214, 1-(4-(trifluoromethoxy)phenyl)cyclopropane-1-carboxylic acid, 1-[4-(trifluoromethoxy)phenyl]cyclopropane-1-carboxylic acid, 1-(4-Trifluoromethoxyphenyl)-1-carboxycyclopropane, SCHEMBL1465617, CTK8E3022, DTXSID20672622, WLYQHMMKMYCFAP-UHFFFAOYSA-N, MFCD11037007, ZINC41701511, AKOS027314062, RP00203, PC404538, SY225843, RT-006030, T6778, Y4765, MFCD11037007 (95%), Cyclopropanecarboxylic acid, 1-[4-(trifluoromethoxy)phenyl]-, 1-(4-(trifluoromethoxy)phenyl)cyclopropanecarboxylic acid, AldrichCPR, C11H9F3O3, (2-(4-chlorophenoxy)phenyl)MethanaMine,

Complexity	302
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	246.05g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	246.185g/mol
Monoisotopic Mass	246.05g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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