AG00DJF4

54209-92-6 | 2(3H)-Benzoxazolone, 5-hydroxy-

AG00DJF4

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CAS Number	54209-92-6
Catalog Number	AG00DJF4(AGN-PC-00S3F1)
Chemical Name	2(3H)-Benzoxazolone, 5-hydroxy-
IUPAC Name	5-hydroxy-3H-1,3-benzoxazol-2-one
InChI	InChI=1S/C7H5NO3/c9-4-1-2-6-5(3-4)8-7(10)11-6/h1-3,9H,(H,8,10)
InChI Key	QBUICLNAZOIKFL-UHFFFAOYSA-N
MDL Number	MFCD11111706
Molecular Formula	C7H5NO3
Molecular Weight	151.1195
SMILES	O=C1OC2=CC=C(O)C=C2N1
Synonyms	54209-92-6, 5-hydroxy-2,3-dihydro-1,3-benzoxazol-2-one, 5-hydroxybenzo[d]oxazol-2(3H)-one, 5-Hydroxy-1,3-benzoxazol-2(3H)-one, 2(3H)-Benzoxazolone, 5-hydroxy-, 2,5-Dihydroxybenzo[d]oxazole, SCHEMBL240915, 5-Hydroxybenzoxazol-2(3H)-one, 5-hydroxy-3H-benzooxazol-2-one, CTK1G8573, 5-Hydroxybenzoxazole-2(3H)-one, DTXSID20581487, QBUICLNAZOIKFL-UHFFFAOYSA-N, 2(3H)-Benzoxazolone, 5-hydroxy-, ZINC34892763, AKOS006307184, 5-Hydroxy-2(3H)-benzoxazolone, AldrichCPR, Z1198314975, 2 -Benzoxazolone,5-hydroxy-,

Complexity	183
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	151.027g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	151.121g/mol
Monoisotopic Mass	151.027g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	58.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P264-P280-P305+P351+P338-P337+P313
UN Code

Certificate of Analysis

Lot Number