5-bromo-2-isocyanato-N,N-dimethyl-benzamide

HCID 57731645
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Basic information

Standard SMILES
CN(C)C(=O)c1cc(Br)ccc1N=C=O
InChIKey
XXYICFGDLSPIKL-UHFFFAOYSA-N
Molecular formula
C10H9BrN2O2
Average molar mass
269.09 g/mol

Names & identifiers

Preferred name
5-bromo-2-isocyanato-N,N-dimethyl-benzamide
IUPAC
5-bromo-2-isocyanato-N,N-dimethylbenzamide

Names & synonyms

SCHEMBL3570646XXYICFGDLSPIKL-UHFFFAOYSA-N5-bromo-2-isocyanato-N,N-dimethylbenzamideDB-3821135-bromo-2-isocyanato-N,N-dimethyl-benzamide1070978-73-2

Database identifiers

PubChem CID
57731645

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
49.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
15

Related reactions

4 records
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Compound notes

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