AG0058D8

807343-01-7 | (2-METHOXYBENZYL)PROPYLAMINE

AG0058D8

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CAS Number	807343-01-7
Catalog Number	AG0058D8(AGN-PC-0LG04D)
Chemical Name	(2-METHOXYBENZYL)PROPYLAMINE
IUPAC Name	N-[(2-methoxyphenyl)methyl]propan-1-amine
InChI	InChI=1S/C11H17NO/c1-3-8-12-9-10-6-4-5-7-11(10)13-2/h4-7,12H,3,8-9H2,1-2H3
InChI Key	JDUNMOVTNMQDIG-UHFFFAOYSA-N
MDL Number	MFCD04503211
Molecular Formula	C11H17NO
Molecular Weight	179.2588
SMILES	CCCNCC1=CC=CC=C1OC
Synonyms	807343-01-7, N-(2-Methoxybenzyl)propan-1-amine, N-[(2-methoxyphenyl)methyl]propan-1-amine, AC1NG05X, N-Propyl-2-methoxybenzylamine, SCHEMBL8138468, KS-00001LBZ, CHEMBRDG-BB 4014223, ZINC7262413, MFCD04503211, AKOS000186962, MCULE-7621892767, [(2-methoxyphenyl)methyl](propyl)amine, AJ-57124, Y-1348, (2-METHOXYBENZYL)PROPYLAMINE, CID4716604,

Complexity	127
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	179.131g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	179.263g/mol
Monoisotopic Mass	179.131g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	21.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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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