5-Bromo-2-cyclopropylmethyl-7-methyl-2,3-dihydro-isoindol-1-one

HCID 57949456
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Basic information

Standard SMILES
Cc1cc(Br)cc2c1C(=O)N(CC1CC1)C2
InChIKey
HEFLGWGPLOFZEW-UHFFFAOYSA-N
Molecular formula
C13H14BrNO
Average molar mass
280.16 g/mol

Names & identifiers

Preferred name
5-Bromo-2-cyclopropylmethyl-7-methyl-2,3-dihydro-isoindol-1-one
IUPAC
5-bromo-2-(cyclopropylmethyl)-7-methyl-3H-isoindol-1-one

Names & synonyms

877149-33-25-bromo-2-cyclopropylmethyl-7-methyl-2,3-dihydro-isoindol-1-oneSCHEMBL1001568HEFLGWGPLOFZEW-UHFFFAOYSA-NDB-3173845-Bromo-7-methyl-2-cyclopropylmethyl-2,3-dihydro-isoindol-1-one

Database identifiers

PubChem CID
57949456

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
20.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
16

Related reactions

4 records
New reaction record

Linked notes

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