AG00BHIC

27914-56-3 | 4-(2,2,2-Trifluoroethoxy)benzoic acid

AG00BHIC

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	27914-56-3
Catalog Number	AG00BHIC(AGN-PC-0KZQ5X)
Chemical Name	4-(2,2,2-Trifluoroethoxy)benzoic acid
IUPAC Name	4-(2,2,2-trifluoroethoxy)benzoic acid
InChI	InChI=1S/C9H7F3O3/c10-9(11,12)5-15-7-3-1-6(2-4-7)8(13)14/h1-4H,5H2,(H,13,14)
InChI Key	FXWBYMLSQLQXAR-UHFFFAOYSA-N
MDL Number	MFCD05669500
Molecular Formula	C9H7F3O3
Molecular Weight	220.1453
SMILES	O=C(O)C1=CC=C(OCC(F)(F)F)C=C1
Synonyms	4-(2,2,2-trifluoroethoxy)benzoic acid, 27914-56-3, Benzoic acid, 4-(2,2,2-trifluoroethoxy)-, AC1MXDHW, AC1Q73G0, SCHEMBL1985055, CTK7I8083, DTXSID20396093, FXWBYMLSQLQXAR-UHFFFAOYSA-N, ZINC4105573, MFCD05669500, SBB023998, STK351047, AKOS000146376, MCULE-4677679936, MS-1273, KS-00000T49, AK174358, ST45119110, V4878, EN300-36001, K-7017, A1-02723, J-016920, Z325208402, C9H7F3O3, CID3763901,

Complexity	219
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	220.035g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	220.147g/mol
Monoisotopic Mass	220.035g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number