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Hexadecyl 2-bromopropanoate

HCID 522109
NotesReactions
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Basic information

CAS
63966-83-6
Standard SMILES
CCCCCCCCCCCCCCCCOC(=O)C(C)Br
InChIKey
LOGGHEZVYPCZGT-UHFFFAOYSA-N
Molecular formula
C19H37BrO2
Average molar mass
377.4 g/mol
Monoisotopic mass
376.19769

Names & identifiers

Preferred name
Hexadecyl 2-bromopropanoate
IUPAC
hexadecyl 2-bromopropanoate

Names & synonyms

Hexadecyl 2-bromopropanoate63966-83-6DTXSID40334851RefChem:347469DTXCID902859402-Bromopropionic acid, hexadecyl esterLOGGHEZVYPCZGT-UHFFFAOYSA-N2- Bromopropionic acid, hexadecyl esterHexadecyl 2-bromopropanoate #hexadecyl alpha-bromopropionate

Database identifiers

CAS
63966-83-6
PubChem CID
522109
DTXSID
DTXSID40334851

Properties

Computed structural properties

XLogP
9.1
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
17
Heavy atoms
22
Formal charge
0
Complexity
244

Related reactions

1 records
New reaction record
HRID 2050125 reaction equation
HRID 2050125As reactantuspto-grants-1980_04

Compound notes

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