AG000BKE

Name: 3-methyl-5-(trifluoromethyl)benzaldehyde
Brand: Angene Chemical
SKU: AG000BKE

116070-39-4 | 3-methyl-5-(trifluoromethyl)benzaldehyde

AG000BKE

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CAS Number	116070-39-4
Catalog Number	AG000BKE(AGN-PC-03YAFE)
Chemical Name	3-methyl-5-(trifluoromethyl)benzaldehyde
IUPAC Name	3-methyl-5-(trifluoromethyl)benzaldehyde
InChI	InChI=1S/C9H7F3O/c1-6-2-7(5-13)4-8(3-6)9(10,11)12/h2-5H,1H3
InChI Key	KFRRYUVXFZQWGS-UHFFFAOYSA-N
MDL Number	MFCD16652409
Molecular Formula	C9H7F3O
Molecular Weight	188.1465
SMILES	O=CC1=CC(C(F)(F)F)=CC(C)=C1
Synonyms	3-Methyl-5-(trifluoromethyl)benzaldehyde, 116070-39-4, MFCD16652409, ACMC-2099ru, SCHEMBL2474610, CTK8A9312, DTXSID60629958, KFRRYUVXFZQWGS-UHFFFAOYSA-N, ANW-16936, ZINC77032107, 3-Trifluoromethyl-5-methylbenzaldehyde, AKOS015956485, AB71420, FCH1180532, AK-93406, AS-46255, CJ-21934, PC302853, AJ-122567, AX8228083, TC-105681, Benzaldehyde, 3-methyl-5-(trifluoromethyl)-, FT-0701899, ST24022951, Z7756, B-8712, C9H7F3O,

Complexity	188
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.045g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	188.149g/mol
Monoisotopic Mass	188.045g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited