AG00HAVU

106877-41-2 | 3-METHOXY-4-(TRIFLUOROMETHYL)PHENOL

AG00HAVU

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CAS Number	106877-41-2
Catalog Number	AG00HAVU(AGN-PC-0NL6F5)
Chemical Name	3-METHOXY-4-(TRIFLUOROMETHYL)PHENOL
IUPAC Name	3-methoxy-4-(trifluoromethyl)phenol
InChI	InChI=1S/C8H7F3O2/c1-13-7-4-5(12)2-3-6(7)8(9,10)11/h2-4,12H,1H3
InChI Key	VWNDFOHZRDLUQY-UHFFFAOYSA-N
MDL Number	MFCD13185696
Molecular Formula	C8H7F3O2
Molecular Weight	192.1352
SMILES	COC1=C(C(F)(F)F)C=CC(O)=C1
Synonyms	3-METHOXY-4-(TRIFLUOROMETHYL)PHENOL, 106877-41-2, Phenol, 3-methoxy-4-(trifluoromethyl)-, SCHEMBL10666026, ZINC34768520, MB13385, AS-46306, ACN-055608,

Complexity	169
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	192.04g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	192.137g/mol
Monoisotopic Mass	192.04g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	29.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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