(methoxycarbonylamino)methyl N-(2-nitro-4-propoxyphenyl)methanimidothioate

CAS: 75255-01-5

Molecular Formula	`C13H17N3O5S`
Molecular Weight	327.36 g/mol
LogP	3.0
Topological Polar Surface Area	131.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	8
Exact Mass	327.0889
Heavy Atoms	22
Complexity	388.0

Chemical Identifiers

CAS Number	75255-01-5
SMILES	`CCCOC1=CC(=C(C=C1)N=CSCNC(=O)OC)[N+](=O)[O-]`
InChIKey	`GJAPTEZCCQHYLN-UHFFFAOYSA-N`

📖 Product Overview

(methoxycarbonylamino)methyl N-(2-nitro-4-propoxyphenyl)methanimidothioate (CAS: 75255-01-5) is a chemical compound with molecular formula C13H17N3O5S and molecular weight 327.36 g/mol. Its IUPAC systematic name is (methoxycarbonylamino)methyl N-(2-nitro-4-propoxyphenyl)methanimidothioate. LogP 3.0 Topological Polar Surface Area 131.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 7 Rotatable Bonds 8 Exact Mass 327.0889 Heavy Atoms 22 Complexity 388.0 InChI Key: GJAPTEZCCQHYLN-UHFFFAOYSA-N. SMILES: CCCOC1=CC(=C(C=C1)N=CSCNC(=O)OC)[N+](=O)[O-].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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