Basic information
- CAS
100399-51-7- Standard SMILES
O=C(O)CCCCCCCC/C=C/Br- InChIKey
PZRZUJZXSTZDBZ-UHFFFAOYSA-N- Molecular formula
- C11H19BrO2
- Average molar mass
- 263.17 g/mol
- Monoisotopic mass
- 262.05684
Names & identifiers
- Preferred name
- 10-Undecenoic acid, 11-bromo-
- IUPAC
- (E)-11-bromoundec-10-enoic acid
- English name
- 11-Bromo-10-undecenoic acid
- Molecular formula
- C11H19BrO2
- Molecular weight
- 263.17
Names & synonyms
100399-51-710-Undecenoic acid, 11-bromo-RefChem:105725211-Bromo-10-undecenoic acid(E)-11-bromoundec-10-enoic acidBRN 1772405SCHEMBL1831828
Database identifiers
- CAS
100399-51-7- PubChem CID
- 6447784
- Nikkaji
- J96.594D
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 167
Physicochemical properties
- EWG's Food Scores
- 1 · 1
Chemistry & industry
Suppliers2 total
Shanghai Medfine Bio-pharmaceutical Co., Ltd+86-86-13013810076 +86-13013810076 · [email protected]
Connect Chemicals GmbH+49 2102 2077 19 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…