AG00EB8Z

61977-29-5 | 6-Chlorobenzo[D]isoxazol-3-ol

AG00EB8Z

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CAS Number	61977-29-5
Catalog Number	AG00EB8Z(AGN-PC-0KL19A)
Chemical Name	6-Chlorobenzo[D]isoxazol-3-ol
IUPAC Name	6-chloro-1,2-benzoxazol-3-one
InChI	InChI=1S/C7H4ClNO2/c8-4-1-2-5-6(3-4)11-9-7(5)10/h1-3H,(H,9,10)
InChI Key	SJAPSPJRTQCDNO-UHFFFAOYSA-N
MDL Number	MFCD00125033
Molecular Formula	C7H4ClNO2
Molecular Weight	169.5652
SMILES	ClC1=CC2=C(C=C1)C(=O)NO2
Synonyms	6-chlorobenzo[d]isoxazol-3-ol, 61977-29-5, 6-Chloro-3-hydroxy-1,2-benzisoxazole, 6-chloro-1,2-benzoxazol-3-one, 6-Chloro-1,2-benzisoxazol-3-ol, 6-chloro-1,2-benzoxazol-3-ol, CHEMBL445990, 6-CHLORO-1,2-BENZISOXAZOL-3(2H)-ONE, 1,2-Benzisoxazol-3(2H)-one,6-chloro-, 1,2-Benzisoxazol-3(2H)-one, 6-chloro-, 6-chlorobenzo(d)isoxazol-3-ol, CBIO, PubChem11268, AC1MD0ZV, MLS000850688, SCHEMBL481926, BDBM23174, CTK5B4114, 3-hydroxy-6-chloro-benzisoxazole, DTXSID70381878, SJAPSPJRTQCDNO-UHFFFAOYSA-N, HMS2790M22, 6-chloranyl-1,2-benzoxazol-3-one, CBIO, >=95% (HPLC), CCG-1741, ANW-63365, BDBM50170230, GEO-03212, KM0561, MFCD00125033, SBB054626, ZINC15923721, 6-Chlorobenzo[d]isoxazol-3(2H)-one, AKOS006230032, AS06205, CM13873, FCH1118751, LS40223, MCULE-2031437500, KS-00003T72, 6-Chloro-1,2-benzoisoxazole-3(2H)-one, AJ-68003, AK-84506, SMR000456705, TS-02303, 6-chlorobenzo[d]isoxazol-3-ol, AldrichCPR, AX8108904, TC-152110, CS-0063922, FT-0621064, ST50949830, 6-chloro-2,3-dihydro-1,2-benzoxazol-3-one, A833514, SR-01000641124-1, I14-101441, ZINC00075896, CID2781852,

Complexity	185
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	168.993g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	169.564g/mol
Monoisotopic Mass	168.993g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	38.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number