基本情報
- CAS
10097-09-3- 標準SMILES
CN(C)C(=O)Nc1ccc(Cc2ccc(NC(=O)N(C)C)cc2)cc1- InChIKey
MOAPNXVHLARBNQ-UHFFFAOYSA-N- 分子式
- C19H24N4O2
- 平均分子量
- 340.4 g/mol
- 単同位体質量
- 340.18992602
概要
See also: Methylene diphenyl bis(dimethyl urea) (annotation moved to).
名称と識別子
- 優先名称
- Urea, N,N''-(methylenedi-4,1-phenylene)bis[N',N'-dimethyl-
- IUPAC
- 3-[4-[[4-(dimethylcarbamoylamino)phenyl]methyl]phenyl]-1,1-dimethylurea
- 現地名
- 3,3′-[メチレンビス(4,1-フェニレン)]ビス(1,1-ジメチル尿素)
- 英語名
- 4,4'-METHYLENE BIS PHENYLDIMETHYL UREA
- 分子式
- C19H24N4O2
- 分子量
- 340.42
名称と別名
Urea, N,N''-(methylenedi-4,1-phenylene)bis[N',N'-dimethyl-3-[4-[[4-(dimethylcarbamoylamino)phenyl]methyl]phenyl]-1,1-dimethylureaDTXSID2074611Urea, N,N''-(methylenedi-4,1-phenylene)bis(N',N'-dimethyl-3-(4-((4-(dimethylcarbamoylamino)phenyl)methyl)phenyl)-1,1-dimethylureaRefChem:901256DTXCID6032568423-370-910097-09-34,4'-Methylene bis phenyldimethyl ureaNSC 202633NSC202633
名称をさらに表示
3,3′-[メチレンビス(4,1-フェニレン)]ビス(1,1-ジメチル尿素)1-[4-({4-[(ジメチルカルバモイル)アミノ]フェニル}メチル)フェニル]-3,3-ジメチル尿素4,4-Methylenediphenylene-bis(dimethylurea)Urea, N,N-(methylenedi-4,1-phenylene)bisN,N-dimethyl-4,4′-Methylene bis phenyldimethyl urea, CAS 10097-09-3N,N''-(Methylenedi-4,1-phenylene)di(N’,N’-dimethylurea)N,N''-(methylenedi-4,1-phenylene)bis[N',N'-dimethyl urea]Urea,N,N''-(methylenedi-4,1-phenylene)bis[n',N'-dimethyl-4,4'-METHYLENE BIS PHENYLDIMETHYL UREA ISO 9001：2015 REACH
SCHEMBL1005604,4'-METHYLENEBIS(1,1-DIMETHYL-3-PHENYLUREA)MOAPNXVHLARBNQ-UHFFFAOYSA-NAKOS024334224NSC-202633NS00020458ST50548538N',N''-[Methylenedi(4,1-phenylene)]bis(N,N-dimethylurea)
データベース識別子
- CAS
10097-09-3- PubChem CID
- 305607
- DTXSID
DTXSID2074611- EC Number
- 423-370-9
- Nikkaji
- J1.975.300J
物性
構造計算による物性
- XLogP
- 2.3
- 極性表面積
- 64.7 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
- 4
- 重原子数
- 25
- 形式電荷
- 0
- 複雑度
- 397
実験および物理化学的性質
Physical DescriptionDry Powder
物理化学的性質
- 融点
- 345 °C · 345 °C
- 沸点
- 595.5 · 595.5±50.0 °C(Predicted)
- 比重(密度)
- 1.204 · 1.204±0.06 g/cm3(Predicted)
- 酸解離定数(Pka)
- 14.71 · 14.71±0.70(Predicted)
- EPAの化学物質情報
- Urea, N,N''-(methylenedi-4,1-phenylene)bis[N',N'-dimethyl- (10097-09-3)
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
This chemical does not meet GHS hazard criteria for 2.6% (1 of 39) of reports.
H412 (94.9%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 4 notifications to the ECHA C&L Inventory.
危険有害性情報
Regulatory Information
Urea, N,N''-(methylenedi-4,1-phenylene)bis[N',N'-dimethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Urea, N,N''-(methylenedi-4,1-phenylene)bis[N',N'-dimethyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
REACH registered substance: 3-[4-[[4-(dimethylcarbamoylamino)phenyl]methyl]phenyl]-1,1-dimethylurea (EC: 423-370-9)
Urea, N,N''-(methylenedi-4,1-phenylene)bis[N',N'-dimethyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesAquatic Chronic 3 (94.9%)
安全データ
- tsca
- TSCA listed
化学と産業
用途と製造
U.S. Production2023: 25,000 - <50,000 lb
Industry UsesCatalyst
General Manufacturing Information
All Other Chemical Product and Preparation Manufacturing
Urea, N,N''-(methylenedi-4,1-phenylene)bis[N',N'-dimethyl-: ACTIVE
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