AG00BIS2

240136-69-0 | 2-AMINO-4-(3-NITROPHENYL)PYRIMIDINE

AG00BIS2

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CAS Number	240136-69-0
Catalog Number	AG00BIS2(AGN-PC-0KK729)
Chemical Name	2-AMINO-4-(3-NITROPHENYL)PYRIMIDINE
IUPAC Name	4-(3-nitrophenyl)pyrimidin-2-amine
InChI	InChI=1S/C10H8N4O2/c11-10-12-5-4-9(13-10)7-2-1-3-8(6-7)14(15)16/h1-6H,(H2,11,12,13)
InChI Key	PHOLBBCMCYYTSJ-UHFFFAOYSA-N
MDL Number	MFCD00665910
Molecular Formula	C10H8N4O2
Molecular Weight	216.1961
SMILES	NC1=NC=CC(C2=CC=CC([N+]([O-])=O)=C2)=N1
Synonyms	4-(3-nitrophenyl)pyrimidin-2-amine, 240136-69-0, 2-Amino-4-(3-nitrophenyl)pyrimidine, PHOLBBCMCYYTSJ-UHFFFAOYSA-N, AK167269, 4-(3-nitrophenyl)pyrimidine-2-ylamine, AC1MC36V, SCHEMBL4706796, CTK7E1201, KS-00000SVR, DTXSID10370701, ZINC2567199, ZX-AT015260, 4-(3-nitrophenyl)-2-pyrimidinamine, BBL003842, MFCD00665910, SBB019169, STK397945, AKOS002659328, DS-9461, MCULE-1230769561, OR60125, 4-(3-nitro-phenyl)-pyrimidin-2-ylamine, NCGC00324698-01, BC4157519, ST4147412, T7557, AB01318207-02, ZINC02567199, CID2735382,

Complexity	256
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	216.065g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	216.2g/mol
Monoisotopic Mass	216.065g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	97.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

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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