4-Chlorobenzyl Bromide

Analyte Name

4-Chlorobenzyl Bromide

CAS Number

622-95-7

Molecular Formula

C42 H78 O3 Si3

Molecular Weight

715.323

Accurate Mass

714.526

SMILES

C[C@H](CCCC(C)(C)O[Si](C)(C)C)[C@H]1CC[C@H]2C(=CCC[C@]12C)C#CC3=C(C)[C@H](C[C@@H](C3)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C

InChI

InChI=1S/C42H78O3Si3/c1-31(21-19-27-41(9,10)45-46(12,13)14)36-25-26-37-33(22-20-28-42(36,37)11)23-24-34-29-35(43-47(15,16)39(3,4)5)30-38(32(34)2)44-48(17,18)40(6,7)8/h22,31,35-38H,19-21,25-30H2,1-18H3/t31-,35-,36-,37+,38+,42-/m1/s1

IUPAC

[(1S,5R)-3-[2-[(1R,3aR,7aR)-7a-methyl-1-[(2R)-6-methyl-6-trimethylsilyloxyheptan-2-yl]-1,2,3,3a,6,7-hexahydroinden-4-yl]ethynyl]-5-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclohex-2-en-1-yl]oxy-tert-butyl-dimethylsilane

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Transport Restrictions

Air Excepted

Product Format

Neat