AG00341Y

220227-98-5 | 4-HYDROXY-3-(TRIFLUOROMETHYL)BENZALDEHYDE

AG00341Y

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CAS Number	220227-98-5
Catalog Number	AG00341Y(AGN-PC-0LW9H7)
Chemical Name	4-HYDROXY-3-(TRIFLUOROMETHYL)BENZALDEHYDE
IUPAC Name	4-hydroxy-3-(trifluoromethyl)benzaldehyde
InChI	InChI=1S/C8H5F3O2/c9-8(10,11)6-3-5(4-12)1-2-7(6)13/h1-4,13H
InChI Key	ZLMUFCNWTPSOSN-UHFFFAOYSA-N
MDL Number	MFCD01091006
Molecular Formula	C8H5F3O2
Molecular Weight	190.1193
SMILES	O=CC1=CC=C(O)C(C(F)(F)F)=C1
Synonyms	4-hydroxy-3-(trifluoromethyl)benzaldehyde, 220227-98-5, 4-hydroxy-3-trifluoromethylbenzaldehyde, Benzaldehyde, 4-hydroxy-3-(trifluoromethyl)-, MFCD01091006, 4-Hydroxy-3-trifluoromethyl-benzaldehyde, AC1ODVOM, PubChem17021, ACMC-209uzy, KSC495O6N, SCHEMBL856316, CTK3J5766, DTXSID20427391, ZLMUFCNWTPSOSN-UHFFFAOYSA-N, 5-Formyl-2-hydroxybenzotrifluoride, 4-Formyl-2-(trifluoromethyl)phenol, AC1Q7869, ACT03516, KS-00000M7B, ZINC2572875, ANW-44444, CL8361, SBB091058, AKOS005254757, CS-W008337, LS11785, PS-8386, RTC-030179, TRA0063935, VZ29171, 4-hydroxy-3(trifluoromethyl)benzaldehyde, 3-(trifluoromethyl)-4-hydroxybenzaldehyde, AC-23720, AJ-42106, AK-34156, AN-29563, CJ-09984, SC-82801, AB0030535, DB-006831, ST2418396, TC-030179, TL8007298, A4730, AM20080770, FT-0080720, FT-0644022, X2735, EN300-67627, H57064, K-6247, 227H985, 4-hydroxy-3-(trifluoromethyl)benzaldehyde, AldrichCPR, I14-92256, C8H5F3O2, ZINC02572875, CID7021593, ?4-Hydroxy-3-(trifluoromethyl)benzaldehyde,

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	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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