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Basic information
- CAS
21667-02-7- Standard SMILES
Cc1ccccc1C(=O)Oc1ccc(N(CCBr)CCBr)cc1- InChIKey
YYLJRENQBJIZGV-UHFFFAOYSA-N- Molecular formula
- C18H19Br2NO2
- Average molar mass
- 441.163 g/mol
- Monoisotopic mass
- 438.97825305
Names & identifiers
- Preferred name
- 4-[Bis(2-bromoethyl)amino]phenyl 2-methylbenzoate
- IUPAC
- 4-[Bis(2-bromoethyl)amino]phenyl 2-methylbenzoate
- English name
- p-(Bis(2-bromoethyl)amino)phenol o-methylbenzoate
- Molecular formula
- C18H19Br2NO2
- Molecular weight
- 441.16
Names & synonyms
4-[Bis(2-bromoethyl)amino]phenyl=2-methylbenzoatep-(Bis(2-bromoethyl)amino)phenol o-methylbenzoateBenzoic acid, 2-methyl-, 4-[bis(2-bromoethyl)amino]phenyl ester
Database identifiers
- CAS
21667-02-7- PubChem CID
- 89005
- DTXSID
DTXSID10944269- ChEMBL
CHEMBL3246932- Nikkaji
- J50.100J
Properties
Physicochemical properties
- Boiling point
- 519.8 · 519.8±50.0 °C(Predicted)
- Density
- 1.539 · 1.539±0.06 g/cm3(Predicted)
- pka
- 3.48 · 3.48±0.50(Predicted)
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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