基本情報
- CAS
56961-69-4- 標準SMILES
O=S(=O)(O)O.c1ccc(Nc2ccccc2)cc1- InChIKey
IPZMDJYHJNHGML-UHFFFAOYSA-N- 分子式
- C12H13NO4S
- 平均分子量
- 267.3 g/mol
- 単同位体質量
- 267.05652907
名称と識別子
- 優先名称
- Diphenylamine sulfate
- IUPAC
- N-phenylaniline;sulfuric acid
- 現地名
- ジフェニルアミン硫酸塩
- 英語名
- Diphenylamine sulfate
- 分子式
- C12H13NO4S
- 分子量
- 267.3
名称と別名
DIPHENYLAMINE SULFATE587-84-8Benzenamine, N-phenyl-, sulfate (1:1)Diphenylamine, hydrogen sulfateDiphenylammonium hydrogen sulphateUSAF EK-743HSDB 2789EINECS 209-605-63257243NLYDTXSID40883450DIPHENYLAMINE SULFATE [MI]RefChem:588885
名称をさらに表示
ジフェニルアミン硫酸塩ジフェニルアミン·硫酸N-フェニルアニリン·硫酸ジフェニルアミン·硫酸塩硫酸ジフェニルアミンusafek-743DiphenylaMine sulfatDiphenylaminesulphateDiphenylamine sulfate,98%Diphenylamine Sulfate >diphenylaminethioacidsaltn-phenyl-benzenamin sulfateDIPHENYLAMINE SULFURIC ACIDN-Phenylaniline·sulfuric acid
DIPHENYLAMINE, SULFATEDTXCID801022980Benzenamine, Nphenyl, sulfate (1:1)209-605-6N-phenylaniline;sulfuric acidN-phenylaniline; sulfuric acid56961-69-4Bis(N-phenylanilinium) sulphate
データベース識別子
- CAS
56961-69-4、587-84-8- PubChem CID
- 11486
- DTXSID
DTXSID40883450- UNII
- 3257243NLY
- EC Number
- 209-605-6、260-473-6
物性
構造計算による物性
- 極性表面積
- 95 Ų
- 水素結合供与体数
- 3
- 水素結合受容体数
- 5
- 回転可能結合数
- 2
- 重原子数
- 18
- 形式電荷
- 0
- 複雑度
- 197
実験および物理化学的性質
PolymersNitrogen Compounds -> Amines, Polyaromatic
Color/FormWHITE TO YELLOWISH POWDER
SolubilityPRACTICALLY INSOL IN WATER; SOL IN ALCOHOL, SULFURIC ACID
DecompositionSEE SULFATES. WHEN HEATED TO DECOMPOSITION, THEY EMIT HIGHLY TOXIC FUMES OF SO(X). /SULFATES/
Melting Point125 °C
Physical DescriptionWhite to yellowish solid; [Merck Index] Slightly yellow powder; [MSDSonline]
物理化学的性質
- 融点
- 144 · 144-148 °C
- 外見
- powder to crystal
- 色
- White to Almost white
- Merck
- 14 · 14,3317
- InChI
- InChI=1S/C12H11N.H2O4S/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-5(2,3)4/h1-10,13H;(H2,1,2,3,4)
- InChIKey
- IPZMDJYHJNHGML-UHFFFAOYSA-N
- SMILES
- S(=O)(=O)(O)O.C1(C=CC=CC=1)NC1=CC=CC=C1
- EPAの化学物質情報
- Benzenamine, N-phenyl-, sulfate (1:1) (587-84-8)
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。
GHS分類
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
危険有害性情報
Hazards SummaryMay cause skin, eye, and respiratory tract irritation, methemoglobinemia, and bladder injury; [Merck Index] Emergency treatment: Aniline; [HSDB] See Diphenylamine.
Toxic Combustion ProductsTOXIC OXIDES OF NITROGEN MAY FORM IN FIRE. /DIPHENYLAMINE/
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Explosive Limits and Potential
DUST MAY BE EXPLOSIVE IF MIXED WITH AIR IN CRITICAL PROPORTIONS & IN PRESENCE OF A SOURCE OF IGNITION. /DIPHENYLAMINE DUST/
/HEXACHLOROMELAMINE EXPLODES WITH DIPHENYLAMINE/...IF AMT /ARE/...LARGE & CONFINED. /DIPHENYLAMINE/
安全と保護具
Fire Fighting ProceduresFOAM, DRY CHEMICAL, CARBON DIOXIDE. WATER OR FOAM MAY CAUSE FROTHING. WEAR GOGGLES & SELF-CONTAINED BREATHING APPARATUS. COOL EXPOSED CONTAINERS WITH WATER /DIPHENYLAMINE/
Storage ConditionsKEEP PROTECTED FROM LIGHT /DIPHENYLAMINE/
Personal Protective Equipment (PPE)RESPIRATOR, SAFETY GOGGLES OR FACE SHIELD; RUBBER GLOVES /DIPHENYLAMINE/
化学と産業
薬理情報
Absorption, Distribution and ExcretionIT IS SIMILAR TO ANILINE...BUT...LESS READILY ABSORBED THROUGH THE SKIN & RESPIRATORY TRACT. /DIPHENYLAMINE/
用途と製造
Uses
Used to make dyes, stabilize nitrocellulose explosives and celluloid, and in analytical chemistry; Also used to test for nitrate and nitrite poisoning and as topical veterinary medication; [Merck Index]
MFR DYES; STABILIZING NITROCELLULOSE EXPLOSIVES & CELLULOID; IN ANALYTICAL CHEMISTRY FOR DETECTION OF NITRATES, CHLORATES & OTHER OXIDIZING SUBSTANCES
MEDICATION (VET): TOPICALLY IN ANTI-SCREWWORM MIXTURES; /PRC: FORMERLY/ IN TESTS FOR NITRATE OR NITRITE POISONING
U.S. Exports(1986) No Data
U.S. Imports(1986) No Data
U.S. Production(1986) No Data
General Manufacturing InformationBenzenamine, N-phenyl-, sulfate (1:1): ACTIVE
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