AG000D6T

116753-54-9 | 1-Propanamine, 3-(4-fluorophenoxy)-

AG000D6T

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CAS Number	116753-54-9
Catalog Number	AG000D6T(AGN-PC-00061H)
Chemical Name	1-Propanamine, 3-(4-fluorophenoxy)-
IUPAC Name	3-(4-fluorophenoxy)propan-1-amine
InChI	InChI=1S/C9H12FNO/c10-8-2-4-9(5-3-8)12-7-1-6-11/h2-5H,1,6-7,11H2
InChI Key	ZIBPUVKKZJRDHB-UHFFFAOYSA-N
MDL Number	MFCD06213776
Molecular Formula	C9H12FNO
Molecular Weight	169.1961
SMILES	FC1=CC=C(OCCCN)C=C1
Synonyms	116753-54-9, 3-(4-Fluorophenoxy)propylamine, 3-(4-FLUOROPHENOXY)PROPAN-1-AMINE, 1-(3-aminopropoxy)-4-fluorobenzene, 1-Propanamine, 3-(4-fluorophenoxy)-, CHEMBL82565, [3-(4-FLUOROPHENOXY)PROPYL]AMINE, PubChem19164, ACMC-1BR1E, AC1Q54JI, SCHEMBL1010758, CTK4A9958, DTXSID40554532, ZIBPUVKKZJRDHB-UHFFFAOYSA-N, 3-(4-Fluoro-phenoxy)-propylamine, KS-000009GV, 3-(4-fluorophenoxy)-1-Propanamine, ANW-16991, BDBM50044451, MFCD06213776, ZINC11569591, 1-Propanamine,3-(4-fluorophenoxy)-, AKOS000123857, MCULE-3183250453, RTR-003045, TRA0096460, AJ-59833, AS-31609, SC-40305, SY008292, AB0062748, AB1001072, DB-060920, TR-003045, BB 0220200, FT-0677466, ST24041467, Z7795, EN300-59449, Z-4047, 3-(4-Fluorophenoxy)-1-propanamine, AldrichCPR, MFCD06213776 (95+%), J-503098, I01-10445, Z1262253020, null, C9H12FNO,

Complexity	113
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	169.09g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	169.199g/mol
Monoisotopic Mass	169.09g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	35.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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