Dimethyl L-glutamate hydrochloride

HCID 12917568CAS 23150-65-4

기본 정보

표준 SMILES: COC(=O)CC[C@H](N)C(=O)OC.Cl
InChIKey: MFUPLHQOVIUESQ-JEDNCBNOSA-N
분자식: C7H14ClNO4
평균 분자량: 211.64 g/mol

이름 및 식별자

우선 이름: Dimethyl L-glutamate hydrochloride
IUPAC: dimethyl (2S)-2-aminopentanedioate;hydrochloride

이름 및 동의어

23150-65-4Dimethyl L-Glutamate Hydrochlorideglutamic acid dimethyl ester hydrochlorideL-Glutamic acid, 1,5-dimethyl ester, hydrochloride (1:1)185VC5X3PFDimethyl L-2-aminoglutarate HClEINECS 245-461-0NSC-83254Dimethyl L-2-aminoglutarate hydrochloridedimethyl glutamate hydrochlorideL-Glutamic acid, dimethyl ester, hydrochlorideNSC 83254

이름 더 보기

GLUTAMIC ACID, DIMETHYL ESTER, HYDROCHLORIDE, L-RefChem:588279L-Glutamic acid dimethyl ester hydrochlorideH-Glu(OMe)-OMe.HClMFCD00038879H-Glu(OMe)-OMe HCldimethyl (2S)-2-aminopentanedioate;hydrochloride1,5-dimethyl (2S)-2-aminopentanedioate hydrochloride

데이터베이스 식별자

CAS: 23150-65-4
PubChem CID: 12917568
ChEMBL: CHEMBL1222010
UNII: 185VC5X3PF
EC Number: 245-461-0

물성

구조 계산 물성

극성 표면적: 78.6 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 5
회전 가능 결합 수: 6
무거운 원자 수: 13
형식 전하: 0
복잡도: 169

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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.