ベンゼンアミン·0.5硫酸塩

Aniline hemisulfate

HCID 10951CAS 542-16-5
部分構造検索類似構造を探す

基本情報

標準SMILES
Nc1ccccc1.Nc1ccccc1.O=S(=O)(O)O
InChIKey
FUKMEFZGEMVGLD-UHFFFAOYSA-N
分子式
C12.H16.N2.O4.S
平均分子量
284.33 g/mol
単同位体質量
284.08307799

名称と識別子

優先名称
Aniline hemisulfate
IUPAC
aniline;sulfuric acid
現地名
ベンゼンアミン·0.5硫酸塩
英語名
Aniline sulfate
分子式
C12H16N2O4S
分子量
284.33

名称と別名

542-16-5Benzenamine, sulfate (2:1)Aniline hemisulfateDianilinium sulphate3BM77321CWANILINE HEMISULPHATEANILINUM SULPHURICUMANILINE HEMISULFATE [MI]DTXSID20883433ANILINUM SULPHURICUM [HPUS]EINECS 208-805-0BENZENAMINE, SULPHATE (2:1)
名称をさらに表示
アニリン·0.5硫酸塩硫酸アニリンアニリンスルファート2アニリン·硫酸アニリン·硫酸ベンゼンアミン·0.5硫酸塩アニリン硫酸塩アニリン サルフェト硫酸アニリン（2：1）アニリン硫酸塩(硫酸アニリン)アニリン硫酸塩( 硫酸アニリン)ANILINE SULFATEANILINE SULPHATEAnilinium SulfateDianilinium sulfateAniline sulfate 98%Benzenamine, sulfateANILINE SULFATE REAGENTBenzenamine,sulfate(2:1)
RefChem:558107DTXCID401022964208-805-0aniline;sulfuric acidMFCD00013110Aniline sulfate saltAniline sulfate, 98%SCHEMBL167326

データベース識別子

CAS
542-16-5
PubChem CID
10951
DTXSID
DTXSID20883433
UNII
3BM77321CW
EC Number
208-805-0

物性

構造計算による物性

極性表面積
135 Ų
水素結合供与体数
4
水素結合受容体数
6
回転可能結合数
0
重原子数
19

実験および物理化学的性質

Chemical ClassesNitrogen Compounds -> Amines, Aromatic
Density1.38 @25 °C
Physical DescriptionSolid; Darkened by air and light; [Merck Index] White odorless powder; [Alfa Aesar MSDS]

物理化学的性質

比重(密度)
1.38 · 1.38
溶解性
5 %、透明、無色 · 水: 可溶5%、透明、無色
外見
powder
色
Nearly white
水溶解度
水に溶ける
BRN
3729533 · 3729533

化学的性質

化学的特性WHITE TO VERY SLIGHTLY YELLOW CRYSTALLINE POWDER

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H301+H311+H331 (90.7%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]

P203, P260, P261, P262, P264, P264+P265, P270, P271, P272, P273, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P316, P317, P318, P319, P321, P330, P333+P317, P361+P364, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 43 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory Information · 2 件

Chemical: Benzenamine, sulfate (2:1)

Benzenamine, sulphate (2:1): Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationEvaluation - Aniline and its salts
Hazards Summary · 1 件

May cause serious eye injury, skin sensitization, and methemoglobinemia; Toxic by ingestion, inhalation, and skin absorption; Prolonged or repeated exposure may cause organ injury; Suspected carcinogen and mutagen; [Alfa Aesar MSDS] See Aniline. See Orthanilic acid.

Hazard Classes and CategoriesAcute Tox. 3 (100%)
Lower Explosive Limit (LEL)13000 [ppm]

安全と保護具

Protective Action Criteria (PAC) · 3 件

1.2 [mg/m3]

13 [mg/m3]

79 [mg/m3]

毒性情報

Adverse EffectsMethemoglobinemia - The presence of increased methemoglobin in the blood; the compound is classified as secondary toxic effect

安全データ

wgk
3
tsca
TSCA listed
ridadr
UN 2811 6.1/PG 3
hs_code
29214200
risk_code
23/24/25-40-41-43-48/23/24/25-50-68
hazard_code
T,N

化学と産業

用途と製造

UsesUsed to make dyes, drugs, resins, varnishes, perfumes, and shoe blacks; Also used for vulcanizing rubber and as a solvent; [Merck Index]
General Manufacturing InformationBenzenamine, sulfate (2:1): ACTIVE
応用分野 · 3 件

用途有機合成原料。

用途植物組織検査、有機合成

使用Aniline sulfate was used as an internal standard in the stereoselective disposition of methamphetamine (MAP, a widely abused drug) study.

上流・下流製品情報

サプライヤー50 社

国药集团化学试剂有限公司86-21-63210123 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]

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