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(~2~H_8_)Hexanedinitrile

HCID 16213232
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
34006-32-1
Standard SMILES
[2H]C([2H])(C#N)C([2H])([2H])C([2H])([2H])C([2H])([2H])C#N
InChIKey
BTGRAWJCKBQKAO-SVYQBANQSA-N
Molecular formula
C6H8N2
Average molar mass
116.1928 g/mol
Monoisotopic mass
116.11896222

Names & identifiers

Preferred name
(~2~H_8_)Hexanedinitrile
IUPAC
(~2~H_8_)Hexanedinitrile
English name
ADIPONITRILE-D8
Molecular formula
C6H8N2
Molecular weight
108.14

Names & synonyms

NSC 7617-d8ADIPONITRILE-D8Adipodinitrile-d8HEXANEDINITRILE-D8Adipic Dinitrile-d81,4-dicyanobutane-d8Adipic Acid Nitrile-d8Butanedicarbonitrile-d8Adipic Acid Dinitrile-d8Adiponitrile-d8

Database identifiers

CAS
34006-32-1
PubChem CID
16213232
DTXSID
DTXSID80583826
EC Number
693-168-5

Properties

Physicochemical properties

Boiling point
295 °C · 295 °C(lit.)
Density
1.021 g/mL · 1.021 g/mL at 25 °C(lit.)
refractive index
20 · n20/D 1.436(lit.)
Flash point
113 °C · 113 °C
storage temp.
Refrigerator
solubility
Chloroform, Ethyl Acetate
form
Oil
color
Yellow
InChI
1S/C6H8N2/c7-5-3-1-2-4-6-8/h1-4H2/i1D2,2D2,3D2,4D2
InChIKey
BTGRAWJCKBQKAO-SVYQBANQSA-N
SMILES
[2H]C([2H])(C#N)C([2H])([2H])C([2H])([2H])C([2H])([2H])C#N
UNSPSC Code
12352202 · 12352202
Symbol(GHS)
6 · GHS06
Signal word
Danger
Hazard statements
301 · H301-H315-H319-H330-H335
Precautionary statements
260 · P260-P284-P301+P310-P305+P351+P338-P310
target organs
Respiratory system
Hazard Codes
T+,T
Risk Statements
26 · 26/27/28-36/37/38-25
Safety Statements
23 · 23-26-36/37/39-45-36
RIDADR
2205 · UN 2205 6.1/PG 3
WGK Germany
3 · 3
Storage Class
6.1 C · 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

Safety & regulation

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

Safety data

wgk
3
ridadr
UN 2205 6.1/PG 3
risk_code
26/27/28-36/37/38-25
Signal word
Danger
Symbol(GHS)
GHS06
hazard_code
T+,T
safety_code
23-26-36/37/39-45-36
Storage Class
6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
target organs
Respiratory system
Hazard statements
H301-H315-H319-H330-H335
Hazard Classifications
Acute Tox. 3 OralAcute Tox. 4 InhalationEye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements
P260-P284-P301+P310-P305+P351+P338-P310

Chemistry & industry

Applications

UsesIsotope Labelled Adipodinitrile is used in the preparation of alkyl/arylthiazolines in the efficient synthesis of bacillamide A. Also used in the preparation of arylketones via insertion of nitriles.

Suppliers9 total

盐城通铭生物科技有限公司15195160625 · [email protected]
艾吉析科技(上海)有限公司17717235263 · [email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
成都思天德生物科技有限公司028-83243028 19136088901 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
艾吉析科技(上海)有限公司17717235263 17717235263 · [email protected]
Clearsynth Canada Inc.+1.415.685.4395 · [email protected]
上海葑菲医药科技有限公司+8618221552033 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Hazard Classifications
3 OralAcute · Acute Tox. 3 OralAcute Tox. 4 InhalationEye Irrit. 2Skin Irrit. 2STOT SE 3