CAS: 25542-62-5
Name: ethyl 6-bromohexanoate
SMILES:
CCOC(=O)CCCCCBrMolecular Processing
Molecular formula
C8H15BrO2
Molecular weight
223.11
Exact mass
222.0255
XLogP
2.5
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
11
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
0.875
Molar refractivity
48.9
Supplementary Information
InChIKey: DXBULVYHTICWKT-UHFFFAOYSA-N
Synonyms
Ethyl 6-bromohexanoate25542-62-5Hexanoic acid, 6-bromo-, ethyl esterEthyl .omega.-bromocaproateEINECS 247-085-2AI3-36603DXBULVYHTICWKT-UHFFFAOYSA-DTXSID601802366-Bromohexanoic acid, ethyl esterEthyl omega-bromocaproateRefChem:138841DTXCID70102727247-085-2DXBULVYHTICWKT-UHFFFAOYSA-NInChI=1/C8H15BrO2/c1-2-11-8(10)6-4-3-5-7-9/h2-7H2,1H36-Bromohexanoic acid ethyl esterMFCD000002706-Bromocaproic Acid Ethyl EsterEthyl 6-BromocaproateEthyl 6-bromocapronateEthyl-6-bromohexanoate6-bromo-hexanoic acid ethyl esterethyl 6bromohexanoateethyl 6- bromohexanoateethyl 6-bromo-hexanoateethyl-6-bromo-hexanoate4VRN6V4YXDSCHEMBL47126Ethyl 6-bromohexanoate, 99%6-bromo-hexaanoic acid ethyl ester
Involved in 176 reactions→