(2S)-1-Methyl-2-pyrrolidinemethanol

HCID 643492CAS 34381-71-0

기본 정보

표준 SMILES: CN1CCC[C@H]1CO
InChIKey: VCOJPHPOVDIRJK-LURJTMIESA-N
분자식: C6H13NO
평균 분자량: 115.17 g/mol
단동위원소 질량: 115.09971404

이름 및 식별자

우선 이름: (2S)-1-Methyl-2-pyrrolidinemethanol
IUPAC: [(2S)-1-methylpyrrolidin-2-yl]methanol

이름 및 동의어

2-Pyrrolidinemethanol, 1-methyl-, (2S)-(2S)-1-Methyl-2-pyrrolidinemethanolDTXSID901295001RefChem:397851DTXCID201725534N-Methyl-L-prolinol34381-71-0(S)-(-)-1-Methyl-2-pyrrolidinemethanol[(2S)-1-methylpyrrolidin-2-yl]methanol(S)-(1-methylpyrrolidin-2-yl)methanolN-methylprolinolMFCD00011727

이름 더 보기

(S)-N-methylpyrrolidine-2-methanol(S)-2-Hydroxymethyl-1-methylpyrrolidine(S)-(-)-2-Hydroxymethyl-1-methylpyrrolidine(1-Methyl-2-pyrrolidinyl)methanol #N-methyl prolinol[(2S)-1-methyl-2-pyrrolidinyl]methanolSCHEMBL84792orb2940037

데이터베이스 식별자

CAS: 34381-71-0
PubChem CID: 643492
DTXSID: DTXSID901295001
EC Number: 251-981-9
Nikkaji: J250.870B

물성

구조 계산 물성

XLogP: 0.1
극성 표면적: 23.5 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 8
형식 전하: 0
복잡도: 74

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (50%): 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 2 reports by companies from 2 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.

유해성 정보

Regulatory Information2-Pyrrolidinemethanol, 1-methyl-, (2S)-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (50%)

규제 정보

Regulatory Information2-Pyrrolidinemethanol, 1-methyl-, (2S)-: Does not have an individual approval but may be used under an appropriate group standard