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(NE)-N-[(7-bromo-2-methyl-1,3-benzoxazol-4-yl)methylidene]hydroxylamine

HCID 58498024
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1nc2c(/C=N/O)ccc(Br)c2o1
InChIKey
CLTDJGVBYXTFEB-NYYWCZLTSA-N
Molecular formula
C9H7BrN2O2
Average molar mass
255.07 g/mol

Names & identifiers

Preferred name
(NE)-N-[(7-bromo-2-methyl-1,3-benzoxazol-4-yl)methylidene]hydroxylamine
IUPAC
(NE)-N-[(7-bromo-2-methyl-1,3-benzoxazol-4-yl)methylidene]hydroxylamine

Names & synonyms

SCHEMBL1355101

Database identifiers

PubChem CID
58498024

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
58.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
14
Formal charge
0
Complexity
237

Related reactions

2 records
New reaction record
HRID 536441 reaction equation
HRID 536441As productuspto-grants-2014_10
HRID 1505254 reaction equation
HRID 1505254As productuspto-grants-2015_12

Compound notes

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