124421-12-1
2-CHLORO-4 6-DIMETHYLPHENYL ISOCYANATE
Name2-CHLORO-4 6-DIMETHYLPHENYL ISOCYANATE
1Identification
【Name】
2-CHLORO-4 6-DIMETHYLPHENYL ISOCYANATE
【CAS】
【MDL】
MFCD03701589
【English Synonyms】
【Formula】
C9 H8 Cl N O
【MolWeight】
181.621
【Inchi】
InChI=1S/C9H8ClNO/c1-6-3-7(2)9(11-5-12)8(10)4-6/h3-4H,1-2H3
【InChIKey】
InChIKey=GRPKAFNBYGDGCX-UHFFFAOYSA-N
【SMILES】
Cc1cc(c(c(c1)Cl)N=C=O)C
【MOL File】
2-CHLORO-4 6-DIMETHY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-CHLORO-4 6-DIMETHYLPHENYL ISOCYANATE.cml