N-[4-[ビス[4-(ジメチルアミノ)フェニル]メチレン]-2,5-シクロヘキサジエン-1-イリデン]-N-メチルベンゼンメタンアミニウム・クロリド

Benzyl[4-[bis[p-(dimethylamino)phenyl]methylene]cyclohexa-2,5-dien-1-ylidene]methylammonium chloride

HCID 22280CAS 5974-19-6

部分構造検索類似構造を探す

基本情報

標準SMILES: CN(C)c1ccc(C(=C2C=CC(=[N+](C)C)C=C2)c2ccc(N(C)Cc3ccccc3)cc2)cc1.[Cl-]
InChIKey: ZMJPCIAEJKVKMQ-UHFFFAOYSA-M
分子式: C31H34ClN3
平均分子量: 484.1 g/mol
単同位体質量: 483.24412577

名称と識別子

優先名称: Benzyl[4-[bis[p-(dimethylamino)phenyl]methylene]cyclohexa-2,5-dien-1-ylidene]methylammonium chloride
IUPAC: [4-[[4-[benzyl(methyl)amino]phenyl]-[4-(dimethylamino)phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium chloride
現地名: N-[4-[ビス[4-(ジメチルアミノ)フェニル]メチレン]-2,5-シクロヘキサジエン-1-イリデン]-N-メチルベンゼンメタンアミニウム・クロリド
英語名: benzyl[4-[bis[p-(dimethylamino)phenyl]methylene]cyclohexa-2,5-dien-1-ylidene]methylammonium chloride
分子式: C31H34ClN3
分子量: 484.07476

名称と別名

Benzyl(4-(bis(p-(dimethylamino)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)methylammonium chlorideBenzenemethanaminium, N-[4-[bis[4-(dimethylamino)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, chlorideBenzyl[4-[bis[p-(dimethylamino)phenyl]methylene]cyclohexa-2,5-dien-1-ylidene]methylammonium chlorideBenzenemethanaminium, N-(4-(bis(4-(dimethylamino)phenyl)methylene)-2,5-cyclohexadien-1-ylidene)-N-methyl-, chlorideRefChem:566892227-772-35974-19-6EINECS 227-772-3Pentamethylbenzyl-p-rosaniline chlorideDTXSID30975151ZMJPCIAEJKVKMQ-UHFFFAOYSA-MAKOS000282976

名称をさらに表示

N-[4-[ビス[4-(ジメチルアミノ)フェニル]メチレン]-2,5-シクロヘキサジエン-1-イリデン]-N-メチルベンゼンメタンアミニウム・クロリドBenzenemethanaminium, N-4-bis4-(dimethylamino)phenylmethylene-2,5-cyclohexadien-1-ylidene-N-methyl-, chloride

NS000466784-({4-[BENZYL(METHYL)AMINO]PHENYL}[4-(DIMETHYLAMINO)PHENYL]METHYLIDENE)-N,N-DIMETHYLCYCLOHEXA-2,5-DIEN-1-IMINIUM CHLORIDE

データベース識別子

CAS: 5974-19-6
PubChem CID: 22280
DTXSID: DTXSID30975151
EC Number: 227-772-3

物性

構造計算による物性

極性表面積: 9.5 Å²
水素結合供与体数: 0
水素結合受容体数: 3
回転可能結合数: 6
重原子数: 35
形式電荷: 0
複雑度: 718

安全と法規制

危険有害性情報

Regulatory Information · 1 件

Benzyl(4-(bis(p-(dimethylamino)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)methylammonium chloride: 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.

化学と産業

サプライヤー1 社

HONEST JOY HOLDINGS LIMITED[email protected]