D-Cysteine hydrochloride monohydrate

HCID 10176341CAS 207121-46-8

기본 정보

표준 SMILES: Cl.N[C@H](CS)C(=O)O.O
InChIKey: QIJRTFXNRTXDIP-NKCUBJMXNA-N
분자식: C3H10ClNO3S
평균 분자량: 175.64 g/mol

이름 및 식별자

우선 이름: D-Cysteine hydrochloride monohydrate
IUPAC: (2S)-2-amino-3-sulfanylpropanoic acid;hydrate;hydrochloride
영어명: D-Cysteine hydrochloride
분자식: C3H10ClNO3S
분자량: 175.63

이름 및 동의어

D-Cysteine hydrochloride monohydrate207121-46-8D-Cysteine hydrochloride hydrate(S)-2-Amino-3-mercaptopropanoic acid hydrochloride hydrateD-Cysteine, hydrochloride, hydrate (1:1:1)MFCD00150051(2S)-2-amino-3-sulfanylpropanoic acid;hydrate;hydrochlorideC3H10ClNO3SD-Cysteine Hydrochloride Hydrate;H-D-Cys-OH.HCl.H2OD-Cysteine HCl hydrate(s)-2-amino-3-mercaptopropanoic acid hydrochloride

이름 더 보기

D-CYSTEINE HCLH-D-Cys-OH·HCl MonohydrateD-Cysteine Hydrochloride D-CYSTEINE HYDROCHLORIDE USP/EP/BPD-CYSTEINE HYDROCHLORIDE, 98.0%(T)TIANFU-CHEM - D-CYSTEINE HYDROCHLORIDED-Cysteine Hydrochloride Monohydrate>D-Cysteine, hydrochloride, hydrate (1:1:1)

d-cysh hclH-D-Cys-OH . HCl . H2Oh-d-cys-oh hclSCHEMBL607664(2S)-2-amino-3-sulfanylpropanoic acid hydrate hydrochlorideFD3010AKOS015855409AC-7470

데이터베이스 식별자

CAS: 207121-46-8
PubChem CID: 10176341
EC Number: 681-546-2

물성

구조 계산 물성

극성 표면적: 65.3 Å²
수소 결합 공여자 수: 5
수소 결합 수용자 수: 5
회전 가능 결합 수: 2
무거운 원자 수: 9
형식 전하: 0
복잡도: 75.3

물리화학적 성질

녹는점: 185 °C · ~185 °C (dec.)
굴절률: -6 ° · -6 ° (C=8, 1mol/L HCl)
저장 조건: 2 · Inert atmosphere,2-8°C
용해도: DMSO(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: 결정성 분말
색상: 흰색에서 노란색으로
수용성: 거의 투명함
InChI: InChI=1/C3H7NO2S.ClH.H2O/c4-2(1-7)3(5)6;;/h2,7H,1,4H2,(H,5,6);1H;1H2/t2-;;/s3
InChIKey: QIJRTFXNRTXDIP-NKCUBJMXNA-N
SMILES: [C@@H](N)(CS)C(=O)O.Cl.O |&1:0,r|

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 4 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

안전 데이터

wgk: 3
HS 번호: 2922.49.4950
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
F 고인화성물질: 3-10-23

화학 및 산업

응용 분야

용도D-Cysteine Hydrochloride Monohydrate is used as a reactant in the expedient synthesis of electronically modified luciferins for bioluminescence imaging.