AG00967G

1079656-75-9 | (1R)-1-[3-FLUORO-4-(TRIFLUOROMETHYL)PHENYL]ETHYLAMINE

AG00967G

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CAS Number	1079656-75-9
Catalog Number	AG00967G(AGN-PC-0WNGN8)
Chemical Name	(1R)-1-[3-FLUORO-4-(TRIFLUOROMETHYL)PHENYL]ETHYLAMINE
IUPAC Name	(1R)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethanamine
InChI	InChI=1S/C9H9F4N/c1-5(14)6-2-3-7(8(10)4-6)9(11,12)13/h2-5H,14H2,1H3/t5-/m1/s1
InChI Key	JGOIWTAAYYAMKP-RXMQYKEDSA-N
MDL Number	MFCD06762190
Molecular Formula	C9H9F4N
Molecular Weight	207.1681
SMILES	C[C@@H](N)C1=CC=C(C(F)(F)F)C(F)=C1
Synonyms	1079656-75-9, (r)-1-(3-fluoro-4-(trifluoromethyl)phenyl)ethanamine, (1R)-1-[3-FLUORO-4-(TRIFLUOROMETHYL)PHENYL]ETHYLAMINE, SCHEMBL4230101, KS-00000U7I, MFCD06762190, ZINC83592976, AKOS025296314, FCH2811755, DS-20020, AX8297290,

Complexity	192
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	207.067g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	207.172g/mol
Monoisotopic Mass	207.067g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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