AG0032LB

34840-23-8 | 1,3-Bis(methoxycarbonyl)-2-methyl-2-thiopseudourea

AG0032LB

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CAS Number	34840-23-8
Catalog Number	AG0032LB(AGN-PC-0RA866)
Chemical Name	1,3-Bis(methoxycarbonyl)-2-methyl-2-thiopseudourea
EC Number	252-240-2
IUPAC Name	methyl N-[(methoxycarbonylamino)-methylsulfanylmethylidene]carbamate
InChI	InChI=1S/C6H10N2O4S/c1-11-5(9)7-4(13-3)8-6(10)12-2/h1-3H3,(H,7,8,9,10)
InChI Key	KHBXLYPOXVQKJG-UHFFFAOYSA-N
MDL Number	MFCD00674104
Molecular Formula	C6H10N2O4S
Molecular Weight	206.2196
SMILES	CS/C(NC(OC)=O)=N/C(OC)=O
Synonyms	34840-23-8, 1,3-Bis(methoxycarbonyl)-2-methyl-2-thiopseudourea, Methyl (((methoxycarbonyl)amino)(methylthio)methylene)carbamate, 1,3-Bis(methoxycarbonyl)-2-methyl-2-thiopseudoeura, 1,3-bis(methoxycarbonyl)-S-methylisothiourea, AC1L40D6, methyl (NZ)-N-[(methoxycarbonylamino)-methylsulfanylmethylidene]carbamate, CTK1C5672, KHBXLYPOXVQKJG-UHFFFAOYSA-N, BCP10631, ZINC1615009, AKOS016038808, 1,3-dicarbomethoxy-S-methylisothiourea, CB-3164, KS-000002F6, N,N'-dicarbomethoxy-S-methylisothiourea, CJ-15710, N,N'-bis-carbomethoxy-S-methylisothiourea, N,N'-bismethoxycarbonyl-S-methylisothiourea, 1,3-bis-methoxycarbonyl-S-methyl isothiourea, N,N'-di(methoxycarbonyl)-S-methylisothiourea, 1,3-bis(methoxycarbonyl)-2-methylisothiourea, 1,3-bis(methoxycarbonyl)-S-methyl isothiourea, 1,3-bis(methoxycarbonyl)-2-methyl-thiopseudourea, 3-Bis(Methoxycarbonyl)-2-Methyl-2-thiopseudourea, 1,3-bis(Methoxycarbonyl)-2-methyl-2-thio-pseudour, 1,3-bis(methoxy carbonyl)-2-methyl-2-thiopseudourea, 1,3-bis(methoxycarbonyl)-2-methyl-2- thiopseudourea, dimethyl[(Z)-(methylsulphanyl)methylylidene]biscarbamate, methyl [(methoxycarbonylamino)(methylthio)methylene]carbamate, methyl N-[(methoxycarbonylamino)-methylsulfanylmethylidene]carbamate, [[[(Methoxycarbonyl)amino](methylthio)methylene]amino]formic acid methyl ester, C6H10N2O4S, CID98708, C6-H10-N2-O4-S, EINECS 252-240-2, EC 252-240-2, METHYL [[(METHOXYCARBONYL)AMINO](METHYLTHIO)METHYLENE]CARBAMATE,

Complexity	229
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	206.036g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	206.216g/mol
Monoisotopic Mass	206.036g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	102A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	1
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P301+P330+P331-P302+P352-P304+P340-P305+P351+P338
UN Code

Certificate of Analysis

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