AG003MQI

90381-08-1 | 5-fluoro-2-trifluoromethylbenzaldehyde

AG003MQI

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CAS Number	90381-08-1
Catalog Number	AG003MQI(AGN-PC-0KK8L5)
Chemical Name	5-fluoro-2-trifluoromethylbenzaldehyde
IUPAC Name	5-fluoro-2-(trifluoromethyl)benzaldehyde
InChI	InChI=1S/C8H4F4O/c9-6-1-2-7(8(10,11)12)5(3-6)4-13/h1-4H
InChI Key	MITVIZWTPVYRDO-UHFFFAOYSA-N
MDL Number	MFCD00236276
Molecular Formula	C8H4F4O
Molecular Weight	192.1104
SMILES	c1cc(c(cc1F)C=O)C(F)(F)F
Synonyms	90381-08-1, 5-fluoro-2-(trifluoromethyl)benzaldehyde, 5-fluoro-2-trifluoromethylbenzaldehyde, 2-Trifluoromethyl-5-fluorobenzaldehyde, OTF-BAD-5F, 5-fluoro-2-trifluoromethyl-benzaldehyde, Benzaldehyde, 5-fluoro-2-(trifluoromethyl)-, MFCD00236276, ALPHA,ALPHA,ALPHA,5-TETRAFLUORO-O-TOLUALDEHYDE, 5-Fluoro-2-(trifluoromethyl)benzaldehyde 97%, PubChem7151, AC1MC7GJ, AC1Q4LMD, SCHEMBL1073123, CTK3J5620, DTXSID50372123, MITVIZWTPVYRDO-UHFFFAOYSA-N, ACT01100, JRD-0745, KS-000011KS, ZINC2560171, ANW-47524, BBL103575, CL8375, SBB091372, STL557385, AKOS005258319, AM84208, AS03135, CM11991, MCULE-6142678832, RP25150, RTC-062310, VZ30310, 5-fluoro-2-(trifluoromethy)-benzaldehyde, AJ-40490, AS-46021, BR-29578, SC-58131, 5-fluoro-2-(trifluoromethyl)-benzaldehyde, 5-fluoranyl-2-(trifluoromethyl)benzaldehyde, AB0027472, Benzaldehyde,5-fluoro-2-(trifluoromethyl)-, DB-057199, TC-062310, 4CH-006816, 5-fluoro-2-(trifluoromethyl)benzaldehyde97%, FT-0642166, ST24029479, ST50826633, TL80074072, W9306, 2 - Trifluoromethyl - 5 - fluorobenzaldehyde, C-5781, A843530, J-517527, 5-Fluoro-2-(trifluoromethyl)benzaldehyde, AldrichCPR, I01-15280, currency, currency, currency,5-tetrafluoro-o-tolualdehyde, alpha,alpha,alpha,5-tetrafluoro-o-tolualdehyde, 4-fluoro-2-formylbenzotrifluoride, C8H4F4O, ZINC02560171, 2-Ttrifluoromethyl-5-fluorobenzaldehyde, CID2737538, 90176-80-0,

Complexity	189
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	192.02g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	192.113g/mol
Monoisotopic Mass	192.02g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P280a-P304+P340-P305+P351+P338-P405-P501a
UN Code

Certificate of Analysis

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