Benzenamine, 4-bromo-2-(4,5-dihydro-3-isoxazolyl)-3-methyl-

HCID 9813747CAS 250592-93-9

Basic information

Standard SMILES
Cc1c(Br)ccc(N)c1C1=NOCC1
InChIKey
ICMSGNRMZFNBLN-UHFFFAOYSA-N
Molecular formula
C10H11BrN2O
Average molar mass
255.11 g/mol
Monoisotopic mass
254.00547507

Names & identifiers

Preferred name
Benzenamine, 4-bromo-2-(4,5-dihydro-3-isoxazolyl)-3-methyl-
IUPAC
4-bromo-2-(4,5-dihydro-1,2-oxazol-3-yl)-3-methylaniline

Names & synonyms

250592-93-94-bromo-2-(4,5-dihydroisoxazol-3-yl)-3-methylaniline4-bromo-2-(4,5-dihydro-1,2-oxazol-3-yl)-3-methylanilineBenzenamine, 4-bromo-2-(4,5-dihydro-3-isoxazolyl)-3-methyl-SCHEMBL702124DTXSID90431086ICMSGNRMZFNBLN-UHFFFAOYSA-N4-bromo-2-(4,5-dihydro-isoxazol-3-yl)-3-methylaniline4-bromo-2-(4,5-dihydroisoxazol-3-yl) -3-methylaniline4-bromo-2-(4,5-dihydro-isoxazol -3-yl)-3-methylaniline

Database identifiers

CAS
250592-93-9
PubChem CID
9813747
DTXSID
DTXSID90431086
EC Number
607-517-6

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
47.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
14

Related reactions

24 records

Linked notes

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