AG00F6UJ

64037-16-7 | 5-Nitrobenzoxazole-2-amine

AG00F6UJ

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CAS Number	64037-16-7
Catalog Number	AG00F6UJ(AGN-PC-0JKV9A)
Chemical Name	5-Nitrobenzoxazole-2-amine
IUPAC Name	5-nitro-1,3-benzoxazol-2-amine
InChI	InChI=1S/C7H5N3O3/c8-7-9-5-3-4(10(11)12)1-2-6(5)13-7/h1-3H,(H2,8,9)
InChI Key	QHVCONQZXJPGQZ-UHFFFAOYSA-N
MDL Number	MFCD01664146
Molecular Formula	C7H5N3O3
Molecular Weight	179.1329
NSC Number	24966
SMILES	NC1=NC2=CC([N+]([O-])=O)=CC=C2O1
Synonyms	64037-16-7, 5-nitrobenzo[d]oxazol-2-amine, 5-nitro-1,3-benzoxazol-2-amine, 2-Amino-5-nitrobenzoxazole, 2-Benzoxazolamine, 5-nitro-, BENZOXAZOLE, 2-AMINO-5-NITRO-, 5-Nitrobenzoxazole-2-amine, NSC24966, 5-Nitro-2-benzoxazolamine, AC1L2FY0, AC1Q52ZV, SCHEMBL10173106, CTK8C0646, KS-00001OPD, DTXSID90214038, ZINC1615409, 9813AB, ANW-65020, MFCD01664146, NSC-24966, AKOS016005101, ACN-048493, MB01969, MCULE-5859471722, NE11914, AJ-28284, AK103196, DA-04824, LS-42138, SC-29034, TC-153765, EN300-33749, 5-nitro-2-imino-2,3-dihydro-1,3-benzoxazole, AB00996811-01, AL-398/12677109, Z351255138, C7H5N3O3, C7-H5-N3-O3, CID46389,

Complexity	218
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	179.033g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	179.135g/mol
Monoisotopic Mass	179.033g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	97.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number