Basic information
- CAS
56266-58-1- Standard SMILES
CCOc1ccc(NC(C)=O)cc1CN(CCBr)CCBr- InChIKey
NORHZSMKLTXYEU-UHFFFAOYSA-N- Molecular formula
- C15H22Br2N2O2
- Average molar mass
- 422.15 g/mol
- Monoisotopic mass
- 420.0048
Names & identifiers
- Preferred name
- Acetanilide, 3'-((bis(2-bromoethyl)amino)methyl)-4'-ethoxy-
- IUPAC
- N-[3-[[bis(2-bromoethyl)amino]methyl]-4-ethoxyphenyl]acetamide
- English name
- 3'-[[Bis(2-bromoethyl)amino]methyl]-4'-ethoxyacetanilide
- Molecular formula
- C15H22Br2N2O2
- Molecular weight
- 422.16
Names & synonyms
56266-58-1ACETANILIDE, 3'-((BIS(2-BROMOETHYL)AMINO)METHYL)-4'-ETHOXY-923J6ZF65SN-(3-((Bis(2-bromoethyl)amino)methyl)-4-ethoxyphenyl)acetamideN-(3-{[bis(2-bromoethyl)amino]methyl}-4-ethoxyphenyl)acetamide3'-((Bis(2-bromoethyl)amino)methyl)-4'-ethoxyacetanilide3-Bis(2-bromoethyl)aminomethyl-4-ethoxy-acetamidobenzeneAcetamide, N-(3-((bis(2-bromoethyl)amino)methyl)-4-ethoxyphenyl)-UNII-923J6ZF65SDTXSID30204817DB-3150013'-[[Bis(2-bromoethyl)amino]methyl ]-4'-ethoxyacetanilide
Show more names
3'-[[Bis(2-bromoethyl)amino]methyl]-4'-ethoxyacetanilideAcetamide, N-[3-[[bis(2-bromoethyl)amino]methyl]-4-ethoxyphenyl]-
Database identifiers
- CAS
56266-58-1- PubChem CID
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 299
Physicochemical properties
- FDA UNII
- 923 J6ZF65S · 923J6ZF65S
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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