AG00CLER

Name: 3-(1,1-Difluoroethyl)aniline
Brand: Angene Chemical
SKU: AG00CLER

40788-05-4 | 3-(1,1-Difluoroethyl)aniline

AG00CLER

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CAS Number	40788-05-4
Catalog Number	AG00CLER(AGN-PC-043AKQ)
Chemical Name	3-(1,1-Difluoroethyl)aniline
IUPAC Name	3-(1,1-difluoroethyl)aniline
InChI	InChI=1S/C8H9F2N/c1-8(9,10)6-3-2-4-7(11)5-6/h2-5H,11H2,1H3
InChI Key	QDGJIBRTFXRYTH-UHFFFAOYSA-N
MDL Number	MFCD20483887
Molecular Formula	C8H9F2N
Molecular Weight	157.1606
SMILES	FC(C)(F)C=1C=C(C=CC1)N
Synonyms	3-(1,1-difluoroethyl)aniline, 40788-05-4, SCHEMBL278943, QDGJIBRTFXRYTH-UHFFFAOYSA-N, 3-(1,1-difluoro-ethyl)-aniline, 3-(1,1-difluoroethyl)benzenamine, KS-00003T3G, [3(1,1-Difluoroethyl)phenyl]amine, ZINC88190045, AKOS023599377, TS-02085, CS-0068819,

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	157.07g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	157.164g/mol
Monoisotopic Mass	157.07g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

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