CAS 2748-02-9 tert-butyl (2S)-2-amino-4-methylpentanoate hydrochloride (HCID 12451443)

기본 정보

CAS: 2748-02-9
표준 SMILES: CC(C)C[C@H](N)C(=O)OC(C)(C)C.Cl
InChIKey: RFUWRXIYTQGFGA-QRPNPIFTSA-N
분자식: C10H22ClNO2
평균 분자량: 223.74 g/mol
단동위원소 질량: 223.13390662

이름 및 식별자

우선 이름: tert-butyl (2S)-2-amino-4-methylpentanoate hydrochloride
IUPAC: tert-butyl (2S)-2-amino-4-methylpentanoate;hydrochloride
영어명: L-Leucine tert-butyl ester hydrochloride
분자식: C10H22ClNO2
분자량: 223.74

이름 및 동의어

TERT-BUTYL (2S)-2-AMINO-4-METHYLPENTANOATE HYDROCHLORIDERefChem:891711854-169-82748-02-9H-Leu-OtBu.HClL-Leucine tert-butyl ester hydrochlorideH-LEU-OTBU HCLMFCD00038906L-Leucine t-butyl ester hydrochlorideL-Leucine tert-butyl ester HCltert-Butyl L-Leucinate hydrochlorideH-Leu-OtBu hydrochloride

이름 더 보기

H-Leu-OtBuH-LEU-OTBU·HCLLeu.OBut.HClH-LEU-OTBU-OHL-Leu-OtBuHClH-LEU-OBUT HCL

(S)-tert-Butyl 2-amino-4-methylpentanoate hydrochlorideleucine t-butyl ester hydrochlorideAKOS015924108L-leucin-tert.-butylester-hydrochlorideL-leucine tert-butyl ester-hydrochlorideEN300-107996M03065L-Leucine t-Butyl Ether Hcl Salt

데이터베이스 식별자

CAS: 2748-02-9
PubChem CID: 12451443
DTXSID: DTXSID20950174
EC Number: 854-169-8

물성

구조 계산 물성

극성 표면적: 52.3 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 3
회전 가능 결합 수: 5
무거운 원자 수: 14
형식 전하: 0
복잡도: 170

물리화학적 성질

녹는점: 167 °C · 167°C(lit.)
저장 조건: -20 °C · Inert atmosphere,Store in freezer, under -20°C
용해도: Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
물리적 상태: 결정성 분말
색상: 하얀색

화학적 성질

Crystalline

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/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 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk: 3
HS 번호: 29224999
safety_code: 24/25
위험 등급: IRRITANT

화학 및 산업

응용 분야 · 1건

용도L-Leucine tert-butyl ester hydrochloride is a protected form of L-Leucine (L330110). L-Leucine is an essential amino acid that induces a sharp decrease in blood glucose levels in individuals with idiopathic familial hypoglycemia, but has no known effects on normal, healthy individuals. L-Leucine also acts as an Isoleucine (I820210) antagonist in the rat, causing delays in growth, and is a potential tumour promoter of bladder cancer.