AG007RJK

1129540-65-3 | 2-Bromo-6-morpholinobenzonitrile

AG007RJK

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CAS Number	1129540-65-3
Catalog Number	AG007RJK(AGN-PC-0WA6AP)
Chemical Name	2-Bromo-6-morpholinobenzonitrile
IUPAC Name	2-bromo-6-morpholin-4-ylbenzonitrile
InChI	InChI=1S/C11H11BrN2O/c12-10-2-1-3-11(9(10)8-13)14-4-6-15-7-5-14/h1-3H,4-7H2
InChI Key	HKIGGSMIIBGCKZ-UHFFFAOYSA-N
MDL Number	MFCD11037772
Molecular Formula	C11H11BrN2O
Molecular Weight	267.1218
SMILES	C1COCCN1C2=C(C(=CC=C2)Br)C#N
Synonyms	2-Bromo-6-morpholinobenzonitrile, 1129540-65-3, ACMC-2099h4, SCHEMBL3752176, CTK8A9264, DTXSID20732437, ANW-16550, MFCD11037772, ZINC85471791, AKOS025404068, 2-Bromo-6-(morpholin-4-yl)benzonitrile, TC-105295, Z7401, B-8837, C11H11BrN2O,

Complexity	257
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	266.005g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	267.126g/mol
Monoisotopic Mass	266.005g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	36.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H312-H315-H319-H332-H335
Packing Group	Ⅲ
Precautionary statements	P261-P280-P304+P340-P305+P351+P338-P405-P501a
UN Code	UN 3439

Certificate of Analysis

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