50818-24-1
ALPHA,ALPHA-DIMETHYL-4-NITRO-BENZENEPROPANOYL CHLORIDE
NameALPHA,ALPHA-DIMETHYL-4-NITRO-BENZENEPROPANOYL CHLORIDE
1Identification
【Name】
ALPHA,ALPHA-DIMETHYL-4-NITRO-BENZENEPROPANOYL CHLORIDE
【CAS】
【MDL】
MFCD22987430
【English Synonyms】
【Formula】
C11 H12 Cl N O3
【MolWeight】
241.673
【Inchi】
InChI=1S/C11H12ClNO3/c1-11(2,10(12)14)7-8-3-5-9(6-4-8)13(15)16/h3-6H,7H2,1-2H3
【InChIKey】
InChIKey=UMQMSAWCRQNEHR-UHFFFAOYSA-N
【SMILES】
CC(C)(Cc1ccc(cc1)[N+](=O)[O-])C(=O)Cl
【MOL File】
ALPHA,ALPHA-DIMETHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ALPHA,ALPHA-DIMETHYL-4-NITRO-BENZENEPROPANOYL CHLORIDE.cml