5801-19-4
1-(3-BROMO-1-METHYLPROPYL)-2,4-DIMETHYL-BENZENE
Name1-(3-BROMO-1-METHYLPROPYL)-2,4-DIMETHYL-BENZENE
1Identification
【Name】
1-(3-BROMO-1-METHYLPROPYL)-2,4-DIMETHYL-BENZENE
【CAS】
【MDL】
MFCD00463886
【English Synonyms】
【Formula】
C12 H17 Br
【MolWeight】
241.17
【Inchi】
InChI=1S/C12H17Br/c1-9-4-5-12(11(3)8-9)10(2)6-7-13/h4-5,8,10H,6-7H2,1-3H3
【InChIKey】
InChIKey=AYOVFFCMRFNDOG-UHFFFAOYSA-N
【SMILES】
Cc1ccc(c(c1)C)C(C)CCBr
【MOL File】
1-(3-BROMO-1-METHYLP….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(3-BROMO-1-METHYLPROPYL)-2,4-DIMETHYL-BENZENE.cml