AG005UP5

704208-25-3 | 7-(Trifluoromethyl)Chroman-4-Amine

AG005UP5

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CAS Number	704208-25-3
Catalog Number	AG005UP5(AGN-PC-0TY4PO)
Chemical Name	7-(Trifluoromethyl)Chroman-4-Amine
IUPAC Name	7-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-amine
InChI	InChI=1S/C10H10F3NO/c11-10(12,13)6-1-2-7-8(14)3-4-15-9(7)5-6/h1-2,5,8H,3-4,14H2
InChI Key	MMCIPVIZAJIRKM-UHFFFAOYSA-N
MDL Number	MFCD11656623
Molecular Formula	C10H10F3NO
Molecular Weight	217.1877
SMILES	NC1CCOC2=C1C=CC(C(F)(F)F)=C2
Synonyms	7-(trifluoromethyl)chroman-4-amine, 704208-25-3, SCHEMBL1980281, CTK5D2367, DTXSID80676388, MMCIPVIZAJIRKM-UHFFFAOYSA-N, ACT06538, BCP27463, EBD39005, 7-Trifluoromethyl-chroman-4-ylamine, 0907AC, ANW-52781, MFCD11656623, AKOS005146436, CT-1046, MB10042, AK-31952, AS-49513, AX8162573, DB-026417, TC-061776, (7-TRIFLUOROMETHYLCHROMAN-4-YL)AMINE, AM20041050, FT-0718065, I14-10401, 2H-1-Benzopyran-4-amine,3,4-dihydro-7-(trifluoromethyl)-, 7-(trifluoromethyl)-3,4-dihydro-2H-1-benzopyran-4-amine, C10H10F3NO, (S)-7-(trifluoromethyl)chroman-4-amine, (R)-7-(trifluoromethyl)chroman-4-amine, A15138, A15765, 1140496-05-4, 1213657-96-5,

Complexity	231
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	217.071g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	217.191g/mol
Monoisotopic Mass	217.071g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	35.2A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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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