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Isopropyl cyanoacrylate

HCID 82744
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Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
10586-17-1
Standard SMILES
C=C(C#N)C(=O)OC(C)C
InChIKey
SQGOMFWCSGKGEP-UHFFFAOYSA-N
Molecular formula
C7H9NO2
Average molar mass
139.15 g/mol
Monoisotopic mass
139.06332853

Overview

polymeric adhesive

Names & identifiers

Preferred name
Isopropyl cyanoacrylate
IUPAC
propan-2-yl 2-cyanoprop-2-enoate
English name
Isopropyl cyanoacrylate
Molecular formula
C7H9NO2
Molecular weight
139.15

Names & synonyms

Isopropyl cyanoacrylate10586-17-1Isopropyl 2-cyanoacrylateI03LI0901Y2-Propenoic acid, 2-cyano-, 1-methylethyl esterDTXSID6065133IPCARefChem:149815DTXCID7032977234-188-2propan-2-yl 2-cyanoprop-2-enoateUNII-I03LI0901Y
Show more names
Isopropyl.alpha.-cyanoacrylateAcrylicacid,2-cyano-,isopropylester2-Cyanoacrylic acid isopropyl ester2-Cyanoacrylic acid 1-methylethyl ester2-propenoic,2-cyano-,1-methylethylester`
Isopropyl alpha-cyanoacrylateAcrylic acid, 2-cyano-, isopropyl esterEINECS 234-188-2isopropyl-2-cyanoacrylatSCHEMBL230496SQGOMFWCSGKGEP-UHFFFAOYSA-N1-methylethyl 2-cyano-2-propanoateAKOS006274664

Database identifiers

CAS
10586-17-1
PubChem CID
82744
DTXSID
DTXSID6065133
UNII
I03LI0901Y
EC Number
234-188-2
Nikkaji
J227.012I

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
50.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
10
Formal charge
0
Complexity
197

Physicochemical properties

Boiling point
53 · 53-56 °C(Press: 2 Torr)
Density
1.0038 g/cm3 · 1.0038 g/cm3
Cosmetics Ingredients Functions
FILM FORMING
LogP
0.57 · 0.570 (est)
EWG's Food Scores
1 · 1-2
FDA UNII
3 LI0901Y · I03LI0901Y
EPA Substance Registry System
2 · Isopropyl 2-cyanoacrylate (10586-17-1)
TSCA
TSCA listed
HS Code
2926909090 · 2926909090

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS ClassificationNot Classified

Hazard information

Regulatory Information · 2 items

Chemical: 2-Propenoic acid, 2-cyano-, 1-methylethyl ester

2-Propenoic acid, 2-cyano-, 1-methylethyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesNot Classified

Safety data

tsca
TSCA listed
hs_code
2926909090

Chemistry & industry

Uses & manufacturing

General Manufacturing Information2-Propenoic acid, 2-cyano-, 1-methylethyl ester: ACTIVE

Related reactions

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Compound notes

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