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2,6-dimethyl-N-pentylphenylcarbamoyl chloride

HCID 53674294
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CCCCCN(C(=O)Cl)c1c(C)cccc1C
InChIKey
BCAXJMDLAZIJHU-UHFFFAOYSA-N
Molecular formula
C14H20ClNO
Average molar mass
253.77 g/mol

Names & identifiers

Preferred name
2,6-dimethyl-N-pentylphenylcarbamoyl chloride
IUPAC
N-(2,6-dimethylphenyl)-N-pentylcarbamoyl chloride

Names & synonyms

SCHEMBL11505884BCAXJMDLAZIJHU-UHFFFAOYSA-N2,6-dimethyl-N-pentylphenylcarbamoyl chloride

Database identifiers

PubChem CID
53674294

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
20.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
5
Heavy atoms
17
Formal charge
0
Complexity
234

Related reactions

2 records
New reaction record
HRID 26021 reaction equation
HRID 26021As productuspto-grants-1979_04
HRID 1447820 reaction equation
HRID 1447820As productuspto-grants-1979_12

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes