AG002TIE

26510-91-8 | Benzenamine, 2,4,5-trimethoxy-

AG002TIE

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CAS Number	26510-91-8
Catalog Number	AG002TIE(AGN-PC-0O8F7C)
Chemical Name	Benzenamine, 2,4,5-trimethoxy-
IUPAC Name	2,4,5-trimethoxyaniline
InChI	InChI=1S/C9H13NO3/c1-11-7-5-9(13-3)8(12-2)4-6(7)10/h4-5H,10H2,1-3H3
InChI Key	SXVWPPJHFOCGAD-UHFFFAOYSA-N
MDL Number	MFCD03840519
Molecular Formula	C9H13NO3
Molecular Weight	183.2044
SMILES	COC1=C(N)C=C(OC)C(OC)=C1
Synonyms	2,4,5-TRIMETHOXYANILINE, 26510-91-8, 2,4,5-trimethoxy aniline, 2,4,5-trimethoxy-phenylamine, SCHEMBL1708452, Benzenamine,2,4,5-trimethoxy-, CTK4F8036, KS-00000MLY, DTXSID80496967, Benzenamine, 2,4,5-trimethoxy-, SXVWPPJHFOCGAD-UHFFFAOYSA-N, 2378AB, 4-bromomethylbenzoic acid ethyl ester, ANW-71589, CT-445, MFCD03840519, ZINC36684062, AKOS009395818, MCULE-9118703617, NE24142, AJ-93292, AK-77628, DS-17183, ST2403636, TC-160334, 4CH-003548, FT-0686999, 510T918, I01-9161, Z1436181414, C9H13NO3,

Complexity	154
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	183.09g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	183.207g/mol
Monoisotopic Mass	183.09g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	53.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

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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