AG002277

1806340-56-6 | 2-Benzoxazolamine, 4-bromo-

AG002277

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CAS Number	1806340-56-6
Catalog Number	AG002277(AGN-PC-0WAN2C)
Chemical Name	2-Benzoxazolamine, 4-bromo-
IUPAC Name	4-bromo-1,3-benzoxazol-2-amine
InChI	InChI=1S/C7H5BrN2O/c8-4-2-1-3-5-6(4)10-7(9)11-5/h1-3H,(H2,9,10)
InChI Key	VDOPLRREAKADRV-UHFFFAOYSA-N
MDL Number	MFCD27922613
Molecular Formula	C7H5BrN2O
Molecular Weight	213.0314
SMILES	NC1=NC2=C(Br)C=CC=C2O1
Synonyms	4-Bromobenzo[d]oxazol-2-amine, 1806340-56-6, 4-bromo-1,3-benzoxazol-2-amine, 2-Benzoxazolamine, 4-bromo-, 2-Amino-4-bromobenzo[d]oxazole, SCHEMBL20298203, KS-00000RLA, MFCD27922613, ZINC95830042, AKOS022173604, DS-4841, FCH2496239, AK134831, AJ-134183, AX8256597,

Complexity	155
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	211.959g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	213.034g/mol
Monoisotopic Mass	211.959g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	52A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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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