8-Bromooctanoic acid
Properties
- Molecular formula
- C8H15BrO2
- Molar mass
- 223.11 g/mol
- Exact mass
- 222.0255 Da
- Melting point
- 38.5 °C
- Boiling point
- 147–150 °C (at 2 Torr)
- logP
- 2.81Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 7
Hazards
Danger
- H314 Causes severe skin burns and eye damage100% of notifiers
- H318 Causes serious eye damage11.5% of notifiers
Aggregated from 52 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, P501
Identifiers
CAS number
17696-11-6SMILES
O=C(O)CCCCCCCBrInChIKey
BKJFDZSBZWHRNH-UHFFFAOYSA-NInChI
InChI=1S/C8H15BrO2/c9-7-5-3-1-2-4-6-8(10)11/h1-7H2,(H,10,11)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- Octanoic acid, 8-bromo-
- Caprylic acid, η-bromo-
- 8-Bromocaprylic acid
- ω-Bromooctanoic acid
Work with 8-Bromooctanoic acid
Similar compounds
17-Bromoheptadecanoic acid13099-35-9100 % similar
16-Bromohexadecanoic acid2536-35-8100 % similar
11-Bromoundecanoic acid2834-05-1100 % similar
7-Bromoheptanoic acid30515-28-7100 % similar
9-Bromononanoic acid41059-02-3100 % similar
6-Bromohexanoic acid4224-70-8100 % similar
10-Bromodecanoic acid50530-12-6100 % similar
12-Bromododecanoic acid73367-80-3100 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.