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54779-85-0
4-CYANO-BENZOYL ISOTHIOCYANATE

Directory: 1. Identification; 2. Chemical and Physical Properties; 3. Material Safety Data Sheet(MSDS); 4. CML File; 5. TOP Suppliers; 6. Related products

Name

4-CYANO-BENZOYL ISOTHIOCYANATE

Formula

C9 H4 N2 O S

MolWeight

188.21

CCD No.

CCD01556632

CAS

54779-85-0

MDL

MFCD12188987

1Identification

【Name】

4-CYANO-BENZOYL ISOTHIOCYANATE

【CAS】

54779-85-0

【MDL】

MFCD12188987

【English Synonyms】

BENZOYL ISOTHIOCYANATE, 4-CYANO-

4-CYANO-BENZOYL ISOTHIOCYANATE

【Formula】

C9 H4 N2 O S

【MolWeight】

188.21

【Inchi】

InChI=1S/C9H4N2OS/c10-5-7-1-3-8(4-2-7)9(12)11-6-13/h1-4H

【InChIKey】

InChIKey=YHOPMABNZKSKRS-UHFFFAOYSA-N

【SMILES】

c1cc(ccc1C#N)C(=O)N=C=S

【MOL File】

4-CYANO-BENZOYL ISOT….mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:0

H bond acceptor:3

XLogP3:1.0

Bulk/Fine:F

3Material Safety Data Sheet(MSDS)

4CML File

4-CYANO-BENZOYL ISOTHIOCYANATE.cml

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54779-85-0 4-CYANO-BENZOYL ISOTHIOCYANATE

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】

【InChIKey】

【SMILES】

【MOL File】

2Chemical and Physical Properties

【Computed Properties】

3Material Safety Data Sheet(MSDS)

4CML File

TOP Suppliers

Related products

54779-85-0
4-CYANO-BENZOYL ISOTHIOCYANATE