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Hexyl 2-cyanoacrylate

HCID 77126
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
3578-06-1
Standard SMILES
C=C(C#N)C(=O)OCCCCCC
InChIKey
XDZLHTBOHLGGCJ-UHFFFAOYSA-N
Molecular formula
C10H15NO2
Average molar mass
181.23 g/mol
Monoisotopic mass
181.11027872

Names & identifiers

Preferred name
Hexyl 2-cyanoacrylate
IUPAC
hexyl 2-cyanoprop-2-enoate
English name
poly(hexyl-2-cyanoacrylate)
Molecular formula
C10H15NO2
Molecular weight
181.2316

Names & synonyms

Hexyl 2-cyanoacrylate3578-06-1EINECS 222-698-8RefChem:146323222-698-8hexyl 2-cyanoprop-2-enoatehexylcyanoacrylateSCHEMBL29340NS00048291Polyhexyl cyanoacrylatepoly(hexyl-2-cyanoacrylate)Hexyl cyanoacrylate polymer
Show more names
2-Propenoic acid, 2-cyano-, hexyl ester, homopolymer

Database identifiers

CAS
3578-06-1
PubChem CID
77126
DTXSID
DTXSID10949678
EC Number
222-698-8
Nikkaji
J216.212A

Properties

Computed structural propertiesFilling in

XLogP
3
Topological polar surface area
50.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
13
Formal charge
0
Complexity
224

Related reactions

3 records
New reaction record
HRID 1045291 reaction equation
HRID 1045291As productuspto-grants-2013_10
HRID 2224011 reaction equation
HRID 2224011As reactantuspto-grants-2008_05
HRID 2224012 reaction equation
HRID 2224012As reactantuspto-grants-2008_05

Compound notes

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