AG019CBC

Name: 2-Trifluoromethylbenzyl mercaptan
Brand: Angene Chemical
SKU: AG019CBC

26039-98-5 | 2-Trifluoromethylbenzyl mercaptan

AG019CBC

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CAS Number	26039-98-5
Catalog Number	AG019CBC(AGN-PC-0WBT5R)
Chemical Name	2-Trifluoromethylbenzyl mercaptan
IUPAC Name	[2-(trifluoromethyl)phenyl]methanethiol
InChI	InChI=1S/C8H7F3S/c9-8(10,11)7-4-2-1-3-6(7)5-12/h1-4,12H,5H2
InChI Key	QJNFWVJTLQZDKZ-UHFFFAOYSA-N
MDL Number	MFCD06798016
Molecular Formula	C8H7F3S
Molecular Weight	192.2014
SMILES	FC(C1=C(CS)C=CC=C1)(F)F
Synonyms	2-Trifluoromethylbenzyl mercaptan, 2-(trifluoromethyl)phenylmethanethiol, 26039-98-5, [2-(trifluoromethyl)phenyl]methanethiol, (2-(trifluoromethyl)phenyl)methanethiol, 2-(trifluoromethyl)benzyl mercaptan, AC1MC4WY, SCHEMBL5206155, CTK8A8831, DTXSID00375765, QJNFWVJTLQZDKZ-UHFFFAOYSA-N, ZINC4244659, BBL100620, GEO-02382, MFCD06798016, STL554414, 2-(trifluoromethyl)benzenemethanethiol, AKOS000169741, MCULE-4744650094, [2-(trifluoromethyl)phenyl]methane-1-thiol, ST51042220, X-4449, 2-(TRIFLUOROMETHYL)PHENYLMETHANETHIOL95%, ZINC04244659, CID2761423,

Complexity	144
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	192.022g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	192.199g/mol
Monoisotopic Mass	192.022g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

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