Carbamic acid, methyl((2-(2-pyridinyl)ethoxy)sulfinyl)-, 3-methylphenyl ester
Basic information
- CAS
84384-87-2- Standard SMILES
Cc1cccc(OC(=O)N(C)S(=O)OCCc2ccccn2)c1- InChIKey
HFTQDXLLOQFODA-UHFFFAOYSA-N- Molecular formula
- C16H18N2O4S
- Average molar mass
- 334.4 g/mol
- Monoisotopic mass
- 334.09872823
Names & identifiers
- Preferred name
- Carbamic acid, methyl((2-(2-pyridinyl)ethoxy)sulfinyl)-, 3-methylphenyl ester
- IUPAC
- (3-methylphenyl) N-methyl-N-(2-pyridin-2-ylethoxysulfinyl)carbamate
Names & synonyms
84384-87-2Methyl((2-(2-pyridinyl)ethoxy)sulfinyl)carbamic acid 3-methylphenyl esterCARBAMIC ACID, METHYL((2-(2-PYRIDINYL)ETHOXY)SULFINYL)-, 3-METHYLPHENYL ESTERRefChem:332485DTXSID9010046563-Methylphenyl methyl{[2-(pyridin-2-yl)ethoxy]sulfinyl}carbamate
Database identifiers
- CAS
84384-87-2- PubChem CID
- 55246
- DTXSID
DTXSID901004656
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 87.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 408
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Compound notes
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