C(CCC(=O)Cl)CCBr
CAS: 22809-37-6
Name: 6-bromohexanoyl chloride
SMILES: C(CCC(=O)Cl)CCBr

Molecular Processing

Molecular formula
C6H10BrClO
Molecular weight
213.5
Exact mass
211.9604
XLogP
2.71
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
5
Heavy atoms
9
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
43.12

Supplementary Information

InChIKey: HBPVGJGBRWIVSX-UHFFFAOYSA-N
Synonyme
6-Bromohexanoyl chloride6-Bromocaproyl chlorideHexanoyl chloride, 6-bromo-6-bromohexanoic chloride6YI1QB4VWJEINECS 245-236-7UNII-6YI1QB4VWJ6-BROMOCAPROIC CHLORIDEDTXSID5066829HBPVGJGBRWIVSX-UHFFFAOYSA-.OMEGA.-BROMOHEXANOYL CHLORIDE.EPSILON.-BROMOCAPROYL CHLORIDERefChem:104331DTXCID6036758OMEGA-BROMOHEXANOYL CHLORIDEEPSILON-BROMOCAPROYL CHLORIDE245-236-7HBPVGJGBRWIVSX-UHFFFAOYSA-NInChI=1/C6H10BrClO/c7-5-3-1-2-4-6(8)9/h1-5H222809-37-66-Bromohexanoylchloride6-Bromohexanoic acid chlorideMFCD00000761C6H10BrClObromohexanoyl chloride6-bromo-hexanoylchloride6-bromo-hexanoyl chlorideSCHEMBL342116-Bromohexanoyl chloride, 97%AKOS015916287
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