AG001T2E

162401-03-8 | Benzenemethanamine, N-ethyl-4-fluoro-

AG001T2E

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CAS Number	162401-03-8
Catalog Number	AG001T2E(AGN-PC-0LG00Y)
Chemical Name	Benzenemethanamine, N-ethyl-4-fluoro-
IUPAC Name	N-[(4-fluorophenyl)methyl]ethanamine
InChI	InChI=1S/C9H12FN/c1-2-11-7-8-3-5-9(10)6-4-8/h3-6,11H,2,7H2,1H3
InChI Key	CURFQQZYGVCIGJ-UHFFFAOYSA-N
MDL Number	MFCD04537942
Molecular Formula	C9H12FN
Molecular Weight	153.1967
SMILES	CCNCC1=CC=C(F)C=C1
Synonyms	N-ETHYL-4-FLUOROBENZYLAMINE, 162401-03-8, N-(4-fluorobenzyl)ethanamine, Ethyl-(4-fluoro-benzyl)-amine, BENZENEMETHANAMINE, N-ETHYL-4-FLUORO-, N-(4-Fluorobenzyl)ethylamine, MFCD04537942, N-[(4-fluorophenyl)methyl]ethanamine, AC1NFZVO, Benzenemethanamine, N-ethyl-4-fluoro- (9CI), 4-fluoro-N-ethylbenzylamine, ethyl (4-fluorobenzyl)amine, SCHEMBL4962736, CTK4D1218, DTXSID80405877, CURFQQZYGVCIGJ-UHFFFAOYSA-N, N-ethyl-4-fluorobenzenemethanamine, ethyl[(4-fluorophenyl)methyl]amine, KS-000009MK, ZINC8227276, 7275AJ, STK510873, AKOS000151949, MCULE-2615170402, TRA0016736, AJ-57377, AM100329, AS-31808, SC-24598, SY002625, DB-018671, TC-308706, FT-0693639, Y-1362, MFCD04537942 (97+%), I01-10461, F2169-1246, C9H12FN, CID4716481, N/A, 14191-95-8,

Complexity	97.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	153.095g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	153.2g/mol
Monoisotopic Mass	153.095g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	12A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314-H318
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 2735

Certificate of Analysis

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