N,N-ジフェニル尿素

1,1-Diphenylurea

HCID 33603CAS 26763-63-3

基本情報

標準SMILES
NC(=O)N(c1ccccc1)c1ccccc1
InChIKey
XKAFKUGMXFMRCC-UHFFFAOYSA-N
分子式
C13H12N2O
平均分子量
212.25 g/mol
単同位体質量
212.094963

概要

Asym-diphenylurea appears as needles or white crystals. (NTP, 1992)

名称と識別子

優先名称
1,1-Diphenylurea
IUPAC
1,1-diphenylurea
現地名
N,N-ジフェニル尿素
英語名
1,1-diphenylurea
分子式
C13H12N2O
分子量
212.25

名称と別名

1,1-DiphenylureaDiphenyl ureaN,N-Diphenylurea603-54-3Urea, N,N-diphenyl-ASYM-DIPHENYLUREACCRIS 4635NSC 8715EINECS 210-048-6AI3-61314NSC-8715H33D27I551
名称をさらに表示
N,N-ジフェニル尿素asym-ジフェニル尿素unsym-ジフェニル尿素1,1-ジフェニル尿素
DIPHENYLUREA, 1,1-DTXSID7025184ACARDIT IAKARDIT IAKARDITE IRefChem:410322UNSYM-DIPHENYLCARBAMIDEDTXCID705184

データベース識別子

CAS
26763-63-3、603-54-3
PubChem CID
33603
DTXSID
DTXSID7025184
ChEMBL
CHEMBL169502
UNII
H33D27I551
EC Number
210-048-6
Nikkaji
J6.809H

物性

構造計算による物性

XLogP
1.5
極性表面積
46.3 Ų
水素結合供与体数
1
水素結合受容体数
1
回転可能結合数
2
重原子数
16

実験および物理化学的性質

SpringerMaterials PropertiesBoiling point
Density1.276 (NTP, 1992) - Denser than water; will sink
Solubilityless than 1 mg/mL at 72 °F (NTP, 1992)
Boiling PointDecomposes (NTP, 1992)
Melting Point372 °F (NTP, 1992)
Physical DescriptionAsym-diphenylurea appears as needles or white crystals. (NTP, 1992)

物理化学的性質

融点
189 °C · 189°C
沸点
352.09 °C · 352.09°C (rough estimate)
比重(密度)
1.276 · 1.2760
屈折率
1.692 · 1.6920 (estimate)
酸解離定数(Pka)
15.11 · 15.11±0.50(Predicted)
安定性
安定。可燃性。強力な酸化剤とは相容れない。

化学的性質

化学的特性white crystals

安全と法規制

危険有害性情報

Fire HazardsFlash point data for this compound are not available, but it is probably combustible. (NTP, 1992)
Reactive GroupAmides and Imides
Reactivity Profile · 1 件

ASYM-DIPHENYLUREA is an amide. Amides/imides react with azo and diazo compounds to generate toxic gases. Flammable gases are formed by the reaction of organic amides/imides with strong reducing agents. Amides are very weak bases (weaker than water). Imides are less basic yet and in fact react with strong bases to form salts. That is, they can react as acids. Mixing amides with dehydrating agents such as P2O5 or SOCl2 generates the corresponding nitrile. The combustion of these compounds generates mixed oxides of nitrogen (NOx).

Air and Water ReactionsThis chemical may be sensitive to prolonged exposure to air or light. (NTP, 1992). Insoluble in water.

安全と保護具

Fire FightingFires involving this compound can be controlled using a dry chemical, carbon dioxide, or Halon extinguisher. (NTP, 1992)
First Aid · 1 件

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1 件

SMALL SPILLS AND LEAKAGE: If a spill of this chemical occurs, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with acetone and transfer the dampened material to a suitable container. Use absorbent paper dampened with acetone to pick up any remaining material. Seal your contaminated clothing and the absorbent paper in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with acetone followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Personal Protective Equipment (PPE) · 1 件

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

安全データ

tsca
TSCA listed

化学と産業

用途と製造

General Manufacturing InformationUrea, N,N-diphenyl-: INACTIVE

応用分野

一般的な説明Needles or white crystals.

調製方法

純化方法Crystallise 1,1-diphenylurea from MeOH. [Beilstein for 1,3 12 IV 741.]

サプライヤー4 社

杭州杰恒化工有限公司0571-87396432 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]

関連反応

8 件

関連ノート

読み込み中…