2-(2H-Pyrrol-2-ylidene)-2,3-dihydro-1,3-benzoxazole

HCID 135625482CAS 54584-08-6
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Basic information

Standard SMILES
c1c[nH]c(-c2nc3ccccc3o2)c1
InChIKey
GBXUJGLSQCSNRP-UHFFFAOYSA-N
Molecular formula
C11H8N2O
Average molar mass
184.19 g/mol

Names & identifiers

Preferred name
2-(2H-Pyrrol-2-ylidene)-2,3-dihydro-1,3-benzoxazole
IUPAC
2-(1H-pyrrol-2-yl)-1,3-benzoxazole

Names & synonyms

54584-08-62-(pyrrol-2-yl)benzoxazoleSCHEMBL9465296SCHEMBL9535172DTXSID70706981GBXUJGLSQCSNRP-UHFFFAOYSA-N2-(1h-pyrrol-2-yl)benzo[d]oxazole2-(2H-Pyrrol-2-ylidene)-2,3-dihydro-1,3-benzoxazole

Database identifiers

CAS
54584-08-6
PubChem CID
135625482
DTXSID
DTXSID70706981
Nikkaji
J2.562.495E

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
41.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
14

Related reactions

1 records
New reaction record

Linked notes

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