2-(4-Methylphenyl)sulfonyloxyimino-2-phenyl-acetonitrile

HCID 308178

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Basic information

CAS
17512-88-8
Standard SMILES
Cc1ccc(S(=O)(=O)ON=C(C#N)c2ccccc2)cc1
InChIKey
LMBCUZJGJVCPSD-UHFFFAOYSA-N
Molecular formula
C15H12N2O3S
Average molar mass
300.3 g/mol
Monoisotopic mass
300.05686324

Names & identifiers

Preferred name
2-(4-Methylphenyl)sulfonyloxyimino-2-phenyl-acetonitrile
IUPAC
[[cyano(phenyl)methylidene]amino] 4-methylbenzenesulfonate

Names & synonyms

17512-88-82-(4-methylphenyl)sulfonyloxyimino-2-phenyl-acetonitrileSCHEMBL35981Benzeneacetonitrile, alpha-[[[(4-methylphenyl)sulfonyl]oxy]imino]-alpha-Tosyloxyiminobenzyl cyanide[[cyano(phenyl)methylidene]amino] 4-methylbenzenesulfonateDTXSID30938625DS-003368{[(4-Methylbenzene-1-sulfonyl)oxy]imino}(phenyl)acetonitrile

Database identifiers

CAS
17512-88-8
PubChem CID
308178
DTXSID
DTXSID30938625

Properties

Computed structural propertiesFilling in

XLogP
3.6
Topological polar surface area
87.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
21

Chemistry & industry

Suppliers1 total

梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]

Related reactions

3 records

Compound notes

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