8-Bromo-3-(n-propylamino)chroman

HCID 19087163
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Basic information

CAS
133118-83-9
Standard SMILES
CCCNC1COc2c(Br)cccc2C1
InChIKey
BWIIWOASRJLDFZ-UHFFFAOYSA-N
Molecular formula
C12H16BrNO
Average molar mass
270.17 g/mol
Monoisotopic mass
269.04152623

Names & identifiers

Preferred name
8-Bromo-3-(n-propylamino)chroman
IUPAC
8-bromo-N-propyl-3,4-dihydro-2H-chromen-3-amine

Names & synonyms

8-bromo-3-(n-propylamino)chromanSCHEMBL9441785BWIIWOASRJLDFZ-UHFFFAOYSA-NDTXSID501220195133118-83-98-Bromo-3,4-dihydro-N-propyl-2H-1-benzopyran-3-amine8-Bromo-N-propyl-3,4-dihydro-2H-1-benzopyran-3-amine

Database identifiers

CAS
133118-83-9
PubChem CID
19087163
DTXSID
DTXSID501220195

Properties

Computed structural propertiesFilling in

XLogP
3.1
Topological polar surface area
21.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
15

Related reactions

3 records
New reaction record

Compound notes

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