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Bicyclo[2.2.1]hept-7-yl acetyl chloride

HCID 21392665
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Basic information

Standard SMILES
O=C(Cl)CC1C2CCC1CC2
InChIKey
ULWUCSVYLLYLFH-UHFFFAOYSA-N
Molecular formula
C9H13ClO
Average molar mass
172.65 g/mol

Names & identifiers

Preferred name
Bicyclo[2.2.1]hept-7-yl acetyl chloride
IUPAC
2-(7-bicyclo[2.2.1]heptanyl)acetyl chloride

Names & synonyms

SCHEMBL11720560ULWUCSVYLLYLFH-UHFFFAOYSA-Nbicyclo[2.2.1]hept-7-yl acetyl chloride

Database identifiers

PubChem CID
21392665

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
11
Formal charge
0
Complexity
158

Related reactions

2 records
New reaction record
HRID 461987 reaction equation
HRID 461987As productuspto-grants-1977_12
HRID 2149736 reaction equation
HRID 2149736As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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