2,2'-(1,3-Phenylene)diacetonitrile | CAS No. 626-22-2

2,2'-(1,3-Phenylene)diacetonitrile

Basic Information

CAS Number

626-22-2

Molecular Formula

C10H8N2

Molecular Weight

17.03 g/mol

AD

Basic Physical Properties

Melting Point

32-35 °C

Boiling Point

170 °C/25 mmHg

Density

1.1566 (rough estimate)

Refractive Index

1.6057 (estimate)

C1=CC(=CC(=C1)CC#N)CC#N

InChI

InChI=1S/C10H8N2/c11-6-4-9-2-1-3-10(8-9)5-7-12/h1-3,8H,4-5H2

InChIKey

GRPFZJNUYXIVSL-UHFFFAOYSA-N

LogP

0.16199999999999998

Topological Polar Surface Area

35.0 Ų

Hydrogen Bond Donor/Acceptor

3 / 1

Complexity

203

Safety Information

View Safety Information

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

  • alpha,alpha'-Dicyano-m-xylene
  • 2,2-(1,3-Phenylene)diacetonitrile
  • m-Xylylene Cyanide
  • InChI=1/C10H8N2/c11-6-4-9-2-1-3-10(8-9)5-7-12/h1-3,8H,4-5H
  • NSC-77095
  • AS-19261
  • 1,3-Phenylenediacetonitrile, 98%
  • 13-Phenylenediacetonitrile
  • 626-22-2
  • NS00016389
  • DTXSID10211645
  • 1,3-Benzenediacetonitrile
  • (3-Cyanomethyl-phenyl)-acetonitrile
  • CCG-48284
  • CDS1_000090
  • s10065
  • WLN: NC1R C1CN
  • A8658
  • Tert-butylN-(2-hydroxy-1-methoxyEthyl)carbamate
  • DivK1c_001130
  • HMS548E02
  • BRN 3240670
  • W-104979
  • NSC 77095
  • 2,2'-(1,3-Phenylene)diacetonitrile
  • EINECS 210-936-3
  • meta-xylylene dicyanide
  • m-Benzenediacetonitrile
  • NSC77095
  • P3W7U10SP7
  • Acetonitrile, m-phenylenedi-

MDL Number

MFCD00001915

Customs Code

29269095

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