2,2-Dimethyl-propionic acid 1H-indazol-6-yl Ester

HCID 69752566
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Basic information

Standard SMILES
CC(C)(C)C(=O)Oc1ccc2cn[nH]c2c1
InChIKey
BYLDJFWUDJNOMU-UHFFFAOYSA-N
Molecular formula
C12H14N2O2
Average molar mass
218.25 g/mol
Monoisotopic mass
218.10552769

Names & identifiers

Preferred name
2,2-Dimethyl-propionic acid 1H-indazol-6-yl Ester
IUPAC
1H-indazol-6-yl 2,2-dimethylpropanoate

Names & synonyms

SCHEMBL6359733BYLDJFWUDJNOMU-UHFFFAOYSA-N2,2-Dimethyl-propionic acid 1H-indazol-6-yl Ester

Database identifiers

PubChem CID
69752566

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
55 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
16

Related reactions

3 records
New reaction record

Linked notes

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