AG0022WK

181473-92-7 | Benzenemethanamine, 5-chloro-2-methoxy-

AG0022WK

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CAS Number	181473-92-7
Catalog Number	AG0022WK(AGN-PC-00PMO1)
Chemical Name	Benzenemethanamine, 5-chloro-2-methoxy-
IUPAC Name	(5-chloro-2-methoxyphenyl)methanamine
InChI	InChI=1S/C8H10ClNO/c1-11-8-3-2-7(9)4-6(8)5-10/h2-4H,5,10H2,1H3
InChI Key	GIGGUFCYUVFLJZ-UHFFFAOYSA-N
MDL Number	MFCD03410973
Molecular Formula	C8H10ClNO
Molecular Weight	171.6241
SMILES	NCC1=CC(Cl)=CC=C1OC
Synonyms	(5-chloro-2-methoxyphenyl)methanamine, 181473-92-7, 5-chloro-2-methoxybenzenemethanamine, Benzenemethanamine, 5-chloro-2-methoxy-, 5-Chloro-2-methoxybenzylamine, 2-Methoxy-5-chlorobenzylamine, SCHEMBL1196055, 5-Chloro-2-methoxy-benzylamine, CTK4D7893, DTXSID80573969, GIGGUFCYUVFLJZ-UHFFFAOYSA-N, ZINC2524606, 9514AA, ANW-52720, MFCD03410973, AKOS000169159, MCULE-6464121625, 1-(5-Chloro-2-methoxyphenyl)methanamine, AJ-37305, AS-49918, SC-28043, DB-000741, ST2408058, TC-062851, AM20030202, BB 0258668, FT-0681593, EN300-58087, Z-1517, AB01002286-01, 127C803, I01-8010, J-501382, C8H10ClNO, (4-chloro-2-methoxyphenyl)methanamine, A15323, 896127-80-3,

Complexity	121
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	171.045g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	171.624g/mol
Monoisotopic Mass	171.045g/mol
Rotatable Bond Count	2
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	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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