2,3-Dihydro-1-methyl-1H-phosphole 1-oxide

HCID 70104CAS 31563-86-7

部分構造検索類似構造を探す

基本情報

標準SMILES: CP1(=O)C=CCC1
InChIKey: IUUONVQOMMQAEH-UHFFFAOYSA-N
分子式: C5H9OP
平均分子量: 116.1 g/mol
単同位体質量: 116.03910154

概要

See also: 1-Methylphospholene 1-oxide (annotation moved to).

名称と識別子

優先名称: 2,3-Dihydro-1-methyl-1H-phosphole 1-oxide
IUPAC: 1-methyl-2,3-dihydro-1λ5-phosphole 1-oxide
英語名: 1H-Phosphole, dihydro-1-methyl-, 1-oxide
分子式: C5H9OP
分子量: 116.098121

名称と別名

2,3-Dihydro-1-methyl-1H-phosphole 1-oxide872-45-71H-Phosphole, dihydro-1-methyl-, 1-oxide1-methyl-1-oxo-phospholene31563-86-71-methyl-2,3-dihydro-1lambda5-phosphole 1-oxideEINECS 212-826-01-methyl-1-oxophospholine1-oxo-1-methylphospholine1-oxo-1-methyl-phospholine1-Methyl-1lambda5-phosphacyclopent-2-ene 1-oxideSCHEMBL436144

名称をさらに表示

Methyl-Phospholen-Oxid

1-methyl-2,3-dihydro-1H-phosphole1-oxide1-methyl-1-phospha -2-cyclopenten-1-oxideNS00043032

データベース識別子

CAS: 31563-86-7、872-45-7
PubChem CID: 70104
DTXSID: DTXSID80953540
EC Number: 212-826-0、608-638-7
Nikkaji: J195.150E

物性

構造計算による物性

XLogP: -0.2
極性表面積: 17.1 Å²
水素結合供与体数: 0
水素結合受容体数: 1
回転可能結合数: 0
重原子数: 7
形式電荷: 0
複雑度: 137

物理化学的性質

EPAの化学物質情報: 1 H-Phosphole, · 1H-Phosphole, dihydro-1-methyl-, 1-oxide (31563-86-7)

安全と法規制

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 1% (2 of 204) of reports.

Warning

H319 (99%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

Aggregated GHS information provided per 204 reports by companies from 3 notifications to the ECHA C&L Inventory.

This chemical does not meet GHS hazard criteria for 100% (37 of 37) of all reports.

危険有害性情報

Hazard Classes and Categories · 2 件

Eye Irrit. 2 (99%)

Not Classified

安全データ

tsca: TSCA listed

化学と産業

用途と製造

General Manufacturing Information1H-Phosphole, dihydro-1-methyl-, 1-oxide: ACTIVE

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