AG0033H5

93071-75-1 | 3-(Trifluoromethoxy)benzylamine

AG0033H5

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CAS Number	93071-75-1
Catalog Number	AG0033H5(AGN-PC-0JMUFA)
Chemical Name	3-(Trifluoromethoxy)benzylamine
IUPAC Name	[3-(trifluoromethoxy)phenyl]methanamine
InChI	InChI=1S/C8H8F3NO/c9-8(10,11)13-7-3-1-2-6(4-7)5-12/h1-4H,5,12H2
InChI Key	TUPUHSXMDIWJQT-UHFFFAOYSA-N
MDL Number	MFCD00061267
Molecular Formula	C8H8F3NO
Molecular Weight	191.1504
SMILES	NCC1=CC=CC(OC(F)(F)F)=C1
Synonyms	3-(Trifluoromethoxy)benzylamine, 93071-75-1, [3-(trifluoromethoxy)phenyl]methanamine, 3-(trifluoromethoxy)benzyl amine, (3-(trifluoromethoxy)phenyl)methanamine, 3-trifluormethoxybenzylamine, m-trifluoromethoxybenzylamine, Benzenemethanamine, 3-(trifluoromethoxy)-, TUPUHSXMDIWJQT-UHFFFAOYSA-N, MFCD00061267, [3-(trifluoromethoxy)phenyl]methylamine, PubChem4433, ACMC-209vkw, AC1L3QU9, 3-Trifluoromethoxybenzylamine, 3-trifluoromethoxy-benzylamine, SCHEMBL111452, m-(Trifluoromethoxy)benzylamine, AC1Q540Q, RARECHEM AL BW 0452, 3-(Trifluoromethyoxy)benzylamine, 3-(trifluoromethoxy) benzylamine, 3-(trifluoromethoxy)-benzylamine, CTK3J5139, DTXSID60239253, 3-Trifluoromethoxybenzenemethanamine, ACT12993, JRD-0351, ZINC4290191, (3-trifluoromethoxyphenyl)methanamine, ANW-45198, CK1121, SBB091248, 3-(Trifluoromethoxy)benzenemethanamine, 3-(TRIFLUOROMETHOXY)BENZYLAMIN, 3-(Trifluoromethoxy)benzylamine, 98%, AKOS009158925, AC-2346, AM62144, AS01943, CS-W004136, MCULE-2738164094, PS-8356, RP25073, RTR-029171, TRA0099555, KS-000001T4, M-(TRIFLUOROMETHOXY)BENZYL AMINE, AJ-50304, AK-48954, AN-14060, BR-48954, SC-45649, SY061747, 1-[3-(Trifluoromethoxy)phenyl]methanamine, 3-(trifluoromethoxy)benzylamine, AldrichCPR, AB0034285, DB-057366, ST2417422, TR-029171, 4CH-014709, FT-0613909, ST50407136, X8408, MFCD00061267 (96%), Z-1400, 071T751, I01-5010, J-511008, 3- BENZYLAMINE, m-trifluoromethoxybenzyl amine, C8H8F3NO, CID145264, 3-(Trifluoromethoxy)benzylamine, 98% - 1G 1g,

Complexity	160
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	191.056g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	191.153g/mol
Monoisotopic Mass	191.056g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	35.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314-H318
Packing Group	Ⅲ
Precautionary statements	P260h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a
UN Code	UN 2735

Certificate of Analysis

Lot Number