基本情報
- CAS
3663-23-8- 標準SMILES
CCCCc1ccc(N)c(N)c1- InChIKey
WQEGHHLKDKIWKM-UHFFFAOYSA-N- 分子式
- C10H16N2
- 平均分子量
- 164.25 g/mol
- 単同位体質量
- 164.13134851
名称と識別子
- 優先名称
- 4-Butyl-1,2-benzenediamine
- IUPAC
- 4-butylbenzene-1,2-diamine
- 現地名
- 4-ブチル-1,2-ベンゼンジアミン
- 英語名
- 4-butylbenzene-1,2-diamine
- 分子式
- C10H16N2
- 分子量
- 164.25
名称と別名
3663-23-81,2-Benzenediamine, 4-butyl-4-BUTYL-1,2-BENZENEDIAMINE4-n-Butyl-o-phenylenediamineo-Phenylenediamine, 4-butyl-HSDB 62694-butyl-O-phenylenediamine3,4-Diamino-1-butylbenzene4-butyl-1,2-phenylenediamineM4GA1B83X0EINECS 222-917-7DTXSID3063120
名称をさらに表示
3,4-ジアミノ-1-ブチルベンゼン4-ブチル-1,2-ベンゼンジアミン4-Butylbenzol-1,2-diamin4-butylbenzene-1,2-diamine1,2-BENZENEDIAMINE,4-BUTYL-4-butylbenzene-1,2-diamine C10H16N2 164.25
2-AMINO-4-N-BUTYLANILINE4-BUTYL-1,2-BENZENEDIAMINE [HSDB]4nButylophenylenediamine4Butylbenzene1,2diamineoPhenylenediamine, 4butylRefChem:5206191,2Benzenediamine, 4butylDTXCID2039207
データベース識別子
- CAS
3663-23-8- PubChem CID
- 19313
- DTXSID
DTXSID3063120- UNII
- M4GA1B83X0
- EC Number
- 222-917-7
- Nikkaji
- J205.577E
物性
構造計算による物性
- XLogP
- 2.1
- 極性表面積
- 52 Ų
- 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
- 3
- 重原子数
- 12
- 形式電荷
- 0
- 複雑度
- 125
実験および物理化学的性質
Chemical ClassesNitrogen Compounds -> Amines, Aromatic
Vapor Pressure0.000174 [mmHg]
物理化学的性質
- 融点
- 38 °C · 38 °C
- 沸点
- 302.3 · 302.3±22.0 °C(Predicted)
- 比重(密度)
- 1.027 · 1.027±0.06 g/cm3(Predicted)
- 酸解離定数(Pka)
- 4.46 · 4.46±0.10(Predicted)
- EPAの化学物質情報
- 1 · 1,2-Benzenediamine, 4-butyl- (3663-23-8)
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
危険有害性情報
Hazards SummaryEmergency treatment: Methemoglobinemia; [HSDB]
Special Reports
EVIDENCE IS GIVEN SUPPORTING TESTING OF THE CLASS OF COMPOUNDS PHENYLENEDIAMINES FOR THEIR TOXIC EFFECTS ON HUMAN HEALTH AND THE ENVIRONMENT. THE RESULTS OF TOXICITY TESTING OF 22 COMPOUNDS ARE TABULATED AS ARE THE EFFECTS FOR WHICH TESTING IS BEING CONSIDERED FOR 13 COMPOUNDS, AND THE USES OR POTENTIAL USES OF 47 PHENYLENEDIAMINES.[UNITED STATES EPA; PHENYLENEDIAMINES; RESPONSE TO INTERAGENCY TESTING COMMITTEE; FED REGIST 47(5) 973 (1982)]
TSCA Requirements
Pursuant to section 8(d) of TSCA, EPA promulgated a model Health and Safety Data Reporting Rule. The section 8(d) model rule requires manufacturers, importers, and processors of listed chemical substances and mixtures to submit to EPA copies and lists of unpublished health and safety studies. 4-Butyl-1,2-benzenediamine is included on this list.
安全と保護具
Disposal Methods
SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.
毒性情報
Adverse EffectsMethemoglobinemia - The presence of increased methemoglobin in the blood; the compound is classified as secondary toxic effect
法規制情報
TSCA Requirements
Pursuant to section 8(d) of TSCA, EPA promulgated a model Health and Safety Data Reporting Rule. The section 8(d) model rule requires manufacturers, importers, and processors of listed chemical substances and mixtures to submit to EPA copies and lists of unpublished health and safety studies. 4-Butyl-1,2-benzenediamine is included on this list.
化学と産業
用途と製造
General Manufacturing Information1,2-Benzenediamine, 4-butyl-: INACTIVE
サプライヤー13 社
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
金瓯生物医药（南京）有限公司13000000000 · [email protected]
郑州阿尔法化工有限公司0371-53778726 18003825608 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
苏州诺行贸易有限公司0512-65816829 18662214788 · [email protected]
河南利恩化工产品有限公司03716091-9097 13383857418 · [email protected]
南京贝开思医药科技有限公司+86-13912903754 13912903754 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
郑州安慕斯化工产品有限公司15981811963 18737195735 · [email protected]
湖北偕丰医药科技有限公司2383948258 19172820304 · [email protected]
関連反応
5 件
化合物ノート
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