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5-(Bicyclo[2.2.1]hept-5-en-2-yl)isoxazole

HCID 178802412
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Basic information

CAS
56342-59-7
Standard SMILES
C1=CC2CC1CC2c1ccno1
InChIKey
PSAGXWGWBDNHMM-UHFFFAOYSA-N
Molecular formula
C10H11NO
Average molar mass
161.2 g/mol

Names & identifiers

Preferred name
5-(Bicyclo[2.2.1]hept-5-en-2-yl)isoxazole
IUPAC
5-(2-bicyclo[2.2.1]hept-5-enyl)-1,2-oxazole
English name
Isoxazole, 5-bicyclo[2.2.1]hept-5-en-2-yl-, exo- (9CI)
Molecular formula
C10H11NO
Molecular weight
161.2

Names & synonyms

5-(Bicyclo[2.2.1]hept-5-en-2-yl)isoxazole56342-59-756342-69-9DB-2421775-(Bicyclo[2.2.1]hept-5-en-2-yl)-1,2-oxazoleIsoxazole, 5-bicyclo[2.2.1]hept-5-en-2-yl-, exo- (9CI)

Database identifiers

CAS
56342-59-7

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
26 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
12
Formal charge
0
Complexity
214

Chemistry & industry

Suppliers1 total

CHEMSTEP[email protected]

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Compound notes

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