AG002D3U

200933-26-2 | Hydrazinecarbothioamide, 2-[(3-nitro-2-pyridinyl)methylene]-, (2E)-

AG002D3U

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CAS Number	200933-26-2
Catalog Number	AG002D3U(AGN-PC-0O7273)
Chemical Name	Hydrazinecarbothioamide, 2-[(3-nitro-2-pyridinyl)methylene]-, (2E)-
IUPAC Name	[(E)-(3-nitropyridin-2-yl)methylideneamino]thiourea
InChI	InChI=1S/C7H7N5O2S/c8-7(15)11-10-4-5-6(12(13)14)2-1-3-9-5/h1-4H,(H3,8,11,15)/b10-4+
InChI Key	PERKXAPWDKXLAU-ONNFQVAWSA-N
MDL Number	MFCD22420461
Molecular Formula	C7H7N5O2S
Molecular Weight	225.2278
SMILES	O=[N+](C1=CC=CN=C1/C=N/NC(N)=S)[O-]
Synonyms	200933-26-2, (E)-2-((3-Nitropyridin-2-yl)methylene)hydrazinecarbothioamide, AK159206, MFCD22420461, AKOS024464494, DS-3208, AX8292574, ST24035022, [(E)-[(3-nitropyridin-2-yl)methylidene]amino]thiourea, (E)-2-((3-Nitropyridin-2-yl)methylene)-hydrazinecarbothioamide, Hydrazinecarbothioamide, 2-[(3-nitro-2-pyridinyl)methylene]-, (2E)-, CID11009629, [(3-nitropyridin-2-yl)methylideneamino]thiourea,

Complexity	277
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	225.032g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	225.226g/mol
Monoisotopic Mass	225.032g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	141A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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