Methyl 2-methyl-2,3-dihydro-1H-isoindole-5-carboxylate

HCID 57423971
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Basic information

Standard SMILES
COC(=O)c1ccc2c(c1)CN(C)C2
InChIKey
PAXVHQBMQVIOQC-UHFFFAOYSA-N
Molecular formula
C11H13NO2
Average molar mass
191.23 g/mol

Names & identifiers

Preferred name
Methyl 2-methyl-2,3-dihydro-1H-isoindole-5-carboxylate
IUPAC
methyl 2-methyl-1,3-dihydroisoindole-5-carboxylate

Names & synonyms

1065065-37-3Methyl 2-methyl-2,3-dihydro-1H-isoindole-5-carboxylateMethyl 2-methyl-5-isoindolinecarboxylateMethyl 2-methylisoindoline-5-carboxylatemethyl 2-methyl-1,3-dihydroisoindole-5-carboxylateSCHEMBL3308449SCHEMBL29715895PAXVHQBMQVIOQC-UHFFFAOYSA-N

Database identifiers

PubChem CID
57423971

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
29.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
14

Related reactions

2 records
New reaction record

Compound notes

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