N-Methyl-L-valine

HCID 444080CAS 2480-23-1

기본 정보

표준 SMILES: CN[C@H](C(=O)O)C(C)C
InChIKey: AKCRVYNORCOYQT-YFKPBYRVSA-N
분자식: C6H13NO2
평균 분자량: 131.17 g/mol
단동위원소 질량: 131.09462866

이름 및 식별자

우선 이름: N-Methyl-L-valine
IUPAC: (2S)-3-methyl-2-(methylamino)butanoic acid

이름 및 동의어

N-Methyl-L-valine2480-23-1L-Valine, N-methyl-(2S)-3-methyl-2-(methylamino)butanoic acidMaVal8JVQ5G9K5V(S)-3-Methyl-2-(methylamino)butyric acidNSC 89800UNII-8JVQ5G9K5VCHEBI:44212METHYLVALINENSC-89800

이름 더 보기

RefChem:163725631-052-8N-Me-Val-OHmethyl-l-valineMFCD00037754N-Methyl- L-valineH-MeVal-OH(S)-3-Methyl-2-(methylamino)butanoic acid

데이터베이스 식별자

CAS: 2480-23-1
PubChem CID: 444080
ChEBI: CHEBI:44212
UNII: 8JVQ5G9K5V
EC Number: 631-052-8
Nikkaji: J441.119F

물성

구조 계산 물성

XLogP: -1.5
극성 표면적: 49.3 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 3
회전 가능 결합 수: 3
무거운 원자 수: 9
형식 전하: 0
복잡도: 101

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H319 (100%): 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 39 reports by companies from 1 notifications to the ECHA C&L Inventory.；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.