AG000LVM

1243395-68-7 | Benzaldehyde, 4-hydroxy-2-(trifluoromethyl)-

AG000LVM

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CAS Number	1243395-68-7
Catalog Number	AG000LVM(AGN-PC-0WAMVS)
Chemical Name	Benzaldehyde, 4-hydroxy-2-(trifluoromethyl)-
IUPAC Name	4-hydroxy-2-(trifluoromethyl)benzaldehyde
InChI	InChI=1S/C8H5F3O2/c9-8(10,11)7-3-6(13)2-1-5(7)4-12/h1-4,13H
InChI Key	MOZHNMRPBKZURU-UHFFFAOYSA-N
MDL Number	MFCD15528830
Molecular Formula	C8H5F3O2
Molecular Weight	190.1193
SMILES	O=CC1=CC=C(O)C=C1C(F)(F)F
Synonyms	4-Hydroxy-2-(trifluoromethyl)benzaldehyde, 1243395-68-7, 4-HYDROXY-2-TRIFLUOROMETHYLBENZALDEHYDE, SCHEMBL3718412, CTK8B6146, DTXSID30677406, ACT03524, KS-00000Q2M, 4592AA, ANW-52853, CL8359, MFCD15528830, ZINC66325510, AKOS015890466, AM84052, CS-W022187, MB14770, AK-94402, DS-17975, SC-53511, AB0069780, AJ-115989, ST2411448, TC-141598, 4CH-016609, Benzaldehyde, 4-hydroxy-2-(trifluoromethyl)-, X-1190, I01-6643, C8H5F3O2,

Complexity	190
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	190.024g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	190.121g/mol
Monoisotopic Mass	190.024g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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