2-(Cyclopropylethynyl)-4-nitroaniline

HCID 59129262
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Basic information

Standard SMILES
Nc1ccc([N+](=O)[O-])cc1C#CC1CC1
InChIKey
ARHQFLVXSKJRHF-UHFFFAOYSA-N
Molecular formula
C11H10N2O2
Average molar mass
202.21 g/mol

Names & identifiers

Preferred name
2-(Cyclopropylethynyl)-4-nitroaniline
IUPAC
2-(2-cyclopropylethynyl)-4-nitroaniline

Names & synonyms

2-(cyclopropylethynyl)-4-nitroaniline952664-83-4SCHEMBL1465043ARHQFLVXSKJRHF-UHFFFAOYSA-NC93198

Database identifiers

PubChem CID
59129262

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
71.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
15

Related reactions

10 records
New reaction record

Compound notes

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