(3S)-pyrrolidin-3-ol

HCID 2733874

ノート反応

データを補完しています。通常は 1 分以内に完了します

部分構造検索類似構造を探す

基本情報

CAS: 100243-39-8
標準SMILES: O[C@H]1CCNC1
InChIKey: JHHZLHWJQPUNKB-BYPYZUCNSA-N
分子式: C4H9NO
平均分子量: 87.12 g/mol
単同位体質量: 87.06841391

名称と識別子

優先名称: (3S)-pyrrolidin-3-ol
IUPAC: (3S)-pyrrolidin-3-ol

名称と別名

(3S)-pyrrolidin-3-ol(+)-3-pyrrolidinolRefChem:401481600-044-6100243-39-8(S)-3-Hydroxypyrrolidine(S)-Pyrrolidin-3-ol(S)-3-Pyrrolidinol3-Pyrrolidinol, (3S)-(S)-(-)-3-Pyrrolidinol(3S)-3-PYRROLIDINOLMFCD00192426

名称をさらに表示

(S)-(+)-3-pyrrolidinol(3S)-3-HYDROXYPYRROLIDINEPP22TE6CNU(S)-3-Hydroxypyrrolidine (>90%)(S)-(-)-3-HYDROXYPYRROLIDINE(S)-pyrrolidine-3-ol(S)-3-hydroxy-pyrrolidinepyrrolidin-3(S)-ol

データベース識別子

CAS: 100243-39-8
PubChem CID: 2733874
UNII: PP22TE6CNU
EC Number: 600-044-6
Nikkaji: J257.528K

物性

構造計算による物性補完中

XLogP: -0.7
極性表面積: 32.3 Å²
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: 0
重原子数: 6
形式電荷: 0
複雑度: 46

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (88.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 9 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.