3,4'-ジアミノジフェニルメタン

Benzenamine, 3-((4-aminophenyl)methyl)-

HCID 146674

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 19430-83-2
標準SMILES: Nc1ccc(Cc2cccc(N)c2)cc1
InChIKey: FGWQCROGAHMWSU-UHFFFAOYSA-N
分子式: C13H14N2
平均分子量: 198.26 g/mol
単同位体質量: 198.11569846

名称と識別子

優先名称: Benzenamine, 3-((4-aminophenyl)methyl)-
IUPAC: 3-[(4-aminophenyl)methyl]aniline
現地名: 3,4'-ジアミノジフェニルメタン
英語名: 3,4'-Diaminodiphenylmethane
分子式: C13H14N2
分子量: 198.26

名称と別名

19430-83-23,4'-DiaminodiphenylmethaneBenzenamine, 3-((4-aminophenyl)methyl)-Benzenamine, 3-[(4-aminophenyl)methyl]-DTXSID30173054RefChem:561706DTXCID5095545623-914-73-(4-Aminobenzyl)aniline3,4'-Methylenedianiline3-[(4-aminophenyl)methyl]aniline4-[(3-aminophenyl)methyl]aniline

名称をさらに表示

3,4'-ジアミノジフェニルメタン3,4'-メチレンジアニリン3,4'-メチレンビスアニリン3,4′-ジアミノジフェニルメタン4-[(3-アミノフェニル)メチル]アニリン3,4′-メチレンビスアニリン3,4′-メチレンジアニリン3,4'-Diaminodiphenylmethane>[3-(4-aminobenzyl)phenyl]amine3,4'-Diaminodiphenylmethane 95%3-[(4-azanylphenyl)methyl]aniline

MFCD000147783,4/'-DIAMINODIPHENYLMETHANE3,4''-MethylenedianilineSCHEMBL125532SCHEMBL287527723,4'-Diaminodiphenylmethane, 95%AKOS004910483AS-58227

データベース識別子

CAS: 19430-83-2
PubChem CID: 146674
DTXSID: DTXSID30173054
EC Number: 623-914-7
Nikkaji: J208.398A

物性

構造計算による物性

XLogP: 2.5
極性表面積: 52 Å²
水素結合供与体数: 2
水素結合受容体数: 2
回転可能結合数: 2
重原子数: 15
形式電荷: 0
複雑度: 185

物理化学的性質

融点: 77 · 77-81 °C
沸点: 393.8 · 393.8±22.0 °C(Predicted)
比重(密度): 1.143 · 1.143±0.06 g/cm3(Predicted)
溶解性: soluble in Methanol
外見: powder to crystal
酸解離定数(Pka): 4.78 · 4.78±0.10(Predicted)
色: White to Light yellow to Light orange
InChI: 1S/C13H14N2/c14-12-6-4-10(5-7-12)8-11-2-1-3-13(15)9-11/h1-7,9H,8,14-15H2
InChIKey: FGWQCROGAHMWSU-UHFFFAOYSA-N
SMILES: Nc1ccc(Cc2cccc(N)c2)cc1
CAS データベース: 19430 · 19430-83-2(CAS DataBase Reference)

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.5%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 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%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.5%)

安全データ

wgk: 2
hs_code: 2921.59.8090
risk_code: 22-36/37/38
hazard_code: Xn
safety_code: 26-36/37
Hazard Classifications: Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
ストレージクラス: 11 - Combustible Solids

化学と産業

上流・下流製品情報

下流製品

食用青色2号

サプライヤー62 社

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]

化合物ノート

読み込み中…