4-(1,3-Benzoxazol-2-yl)-2-methoxybenzonitrile

HCID 21990987
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Basic information

Standard SMILES
COc1cc(-c2nc3ccccc3o2)ccc1C#N
InChIKey
NJLAMAKQEJLCLH-UHFFFAOYSA-N
Molecular formula
C15H10N2O2
Average molar mass
250.25 g/mol

Names & identifiers

Preferred name
4-(1,3-Benzoxazol-2-yl)-2-methoxybenzonitrile
IUPAC
4-(1,3-benzoxazol-2-yl)-2-methoxybenzonitrile

Names & synonyms

SCHEMBL5832486NJLAMAKQEJLCLH-UHFFFAOYSA-N4-(1,3-benzoxazol-2-yl)-2-methoxybenzonitrile

Database identifiers

PubChem CID
21990987

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
59.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
19

Related reactions

4 records
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Compound notes

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