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Carbamic acid, thiobis(N-methyl-, 3-isopropylphenyl propyl ester

HCID 47766
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
65907-45-1
Standard SMILES
CCCOC(=O)NCSCNC(=O)Oc1cccc(C(C)C)c1
InChIKey
PLIVPQIZPXZPNR-UHFFFAOYSA-N
Molecular formula
C16H24N2O4S
Average molar mass
340.4 g/mol
Monoisotopic mass
340.14567842

Names & identifiers

Preferred name
Carbamic acid, thiobis(N-methyl-, 3-isopropylphenyl propyl ester
IUPAC
propyl N-[[(3-propan-2-ylphenoxy)carbonylamino]methylsulfanylmethyl]carbamate
English name
N-[[N-(Propoxycarbonyl)-N-methylamino]thio]N-methylcarbamic acid 3-isopropylphenyl ester
Molecular formula
C16H24N2O4S
Molecular weight
340.44

Names & synonyms

Thiobis(N-methylcarbamic acid)-3-isopropylphenyl propyl esterBRN 2174284CARBAMIC ACID, THIOBIS(N-METHYL-, 3-ISOPROPYLPHENYL PROPYL ESTER65907-45-1DTXSID90216138RefChem:332749DTXCID901386293-(Propan-2-yl)phenyl propyl [sulfanediylbis(methylene)]biscarbamateFluopyram Impurity 36-Oxa-3-thia-2,4-diazanonanoic acid, 2,4-dimethyl-5-oxo-, 3-(1-methylethyl)phenyl esterN-[[N-(Propoxycarbonyl)-N-methylamino]thio]N-methylcarbamic acid 3-isopropylphenyl ester

Database identifiers

CAS
65907-45-1
PubChem CID
47766
DTXSID
DTXSID90216138

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
102 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
10
Heavy atoms
23
Formal charge
0
Complexity
366

Related reactions

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Compound notes

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