2-[(ジメチルアミノ)メチレン]プロパンジニトリル

((Dimethylamino)methylene)propanedinitrile

HCID 28111
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基本情報

CAS
16849-88-0
標準SMILES
CN(C)C=C(C#N)C#N
InChIKey
LBUDLOYYNHQKQI-UHFFFAOYSA-N
分子式
C6H7N3
平均分子量
121.14 g/mol
単同位体質量
121.06399724

名称と識別子

優先名称
((Dimethylamino)methylene)propanedinitrile
IUPAC
2-(dimethylaminomethylidene)propanedinitrile
現地名
2-[(ジメチルアミノ)メチレン]プロパンジニトリル
英語名
(Dimethylaminomethylene)malononitrile
分子式
C6H7N3
分子量
121.14

名称と別名

16849-88-0MALONONITRILE, ((DIMETHYLAMINO)METHYLENE)-[(dimethylamino)methylene]malononitrile((Dimethylamino)methylene)malonitrilePropanedinitrile, 2-[(dimethylamino)methylene]-alpha-Cyano-beta-dimethylaminoacrylonitrileEINECS 240-873-7Propanedinitrile, ((dimethylamino)methylene)-Propanedinitrile, [(dimethylamino)methylene]-((Dimethylamino)methylene)malononitrileNSC 168421BRN 2038990
名称をさらに表示
ジメチルアミノメチレンマロノニトリル[(ジメチルアミノ)メチレン]マロノニトリル(ジメチルアミノメチレン)マロノニトリル2-[(ジメチルアミノ)メチレン]プロパンジニトリルジメチルアミノメチレンマロンニトリル2-[(ジメチルアミノ)メチリデン]プロパンジニトリル[(ｼﾞﾒﾁﾙｱﾐﾉ)ﾒﾁﾚﾝ]ﾌﾟﾛﾊﾟﾝｼﾞﾆﾄﾘﾙ3-DIMETHYLAMINO-2-CYANOACRYLONITRILE1-(dimethylamine)-2,2-dicyanoethylene(Dimethylaminomethylene)malononitrile2-DiMethylaMinoMethylene-Malononitrile2-CYANO-3-(DIMETHYLAMINO)ACRYLONITRILE((dimethylamino)methylene)-malononitril2-[(DIMETHYLAMINO)METHYLIDENE]MALONONITRILE
9VE2L03HB0NSC-168421((Dimethylamino)methylene)propanedinitrileDTXSID401685722-((DIMETHYLAMINO)METHYLENE)PROPANEDINITRILEPROPANEDINITRILE, 2-((DIMETHYLAMINO)METHYLENE)-[(Dimethylamino)methylene]propanedinitrileRefChem:390381

データベース識別子

CAS
16849-88-0
PubChem CID
28111
DTXSID
DTXSID40168572
UNII
9VE2L03HB0
EC Number
240-873-7
Nikkaji
J41.622C

物性

構造計算による物性

XLogP
0.3
極性表面積
50.8 Ų
水素結合供与体数
0
水素結合受容体数
3
回転可能結合数
1
重原子数
9

物理化学的性質

融点
84 · 84-85 °C(lit.)
沸点
215.85 °C · 215.85°C (rough estimate)
比重(密度)
1.0556 · 1.0556 (rough estimate)
屈折率
1.469 · 1.4690 (estimate)
貯蔵温度
-20 °C · -20°C Freezer
溶解性
メタノール（微量）、水（微量）

化学的性質

化学的特性Green Solid

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Acute Tox. 4 (100%)

安全データ

wgk
3
rtecs
OO3746000
ridadr
UN3276
hs_code
29269095
risk_code
20/21/22
hazard_code
Xn,Xi

化学と産業

応用分野

使用[(Dimethylamino)methylene]malononitrile (cas# 16849-88-0) is a compound useful in organic synthesis.

上流・下流製品情報

サプライヤー32 社

Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海皓竹医药科技有限公司18912729622 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]

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