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Carbamic acid, N-(O,O-diethylphosphorothioyl)-N-methyl-, O-isopropoxyphenyl ester

HCID 34333
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Basic information

CAS
28789-77-7
Standard SMILES
CCOP(=S)(OCC)N(C)C(=O)Oc1ccccc1OC(C)C
InChIKey
MYNSPGUPGPWCGJ-UHFFFAOYSA-N
Molecular formula
C15H24NO5PS
Average molar mass
361.4 g/mol
Monoisotopic mass
361.11128104

Names & identifiers

Preferred name
Carbamic acid, N-(O,O-diethylphosphorothioyl)-N-methyl-, O-isopropoxyphenyl ester
IUPAC
(2-propan-2-yloxyphenyl) N-diethoxyphosphinothioyl-N-methylcarbamate
English name
N-(Diethoxyphosphinothioyl)-N-methylcarbamic acid o-isopropoxyphenyl ester
Molecular formula
C15H24NO5PS
Molecular weight
361.39

Names & synonyms

AKK856SR4KNSC 132947BRN 201492028789-77-7Carbamic acid, (diethoxyphosphinothioyl)methyl-, o-isopropoxyphenyl esterCarbamic acid, N-(O,O-diethylphosphorothioyl)-N-methyl-, O-isopropoxyphenyl esterNSC-132947DTXSID70182968O-Isopropoxyphenyl N-(O,O-diethylphosphorothioyl)-N-methylcarbamateRefChem:123415DTXCID10105459Carbamic acid, (diethoxyphosphinothioyl)methyl-, o-isopropoxyphenyl ester (8CI)
Show more names
Reaxys ID: 2014920N-(Diethoxyphosphinothioyl)-N-methylcarbamic acid o-isopropoxyphenyl ester
UNII-AKK856SR4KNSC132947Carbamic acid, o-isopropoxyphenyl ester2-[(Propan-2-yl)oxy]phenyl (diethoxyphosphorothioyl)(methyl)carbamate

Database identifiers

CAS
28789-77-7
PubChem CID
34333
DTXSID
DTXSID70182968
UNII
AKK856SR4K
Nikkaji
J48.524A

Properties

Computed structural properties

XLogP
4
Topological polar surface area
89.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
9
Heavy atoms
23
Formal charge
0
Complexity
411

Physicochemical properties

FDA UNII
856 SR4K · AKK856SR4K

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Compound notes

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