HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

(2S,4S)-1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate hydrochloride

HCID 178790489
New noteNew reactionRequest quotes
Print preview

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
1515919-15-9
Standard SMILES
COC(=O)[C@@H]1C[C@H](N)CN1C(=O)OCc1ccccc1.Cl
InChIKey
VLLRSJJKBDFSMT-FXMYHANSSA-N
Molecular formula
C14H19ClN2O4
Average molar mass
314.76 g/mol

Names & identifiers

Preferred name
(2S,4S)-1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate hydrochloride
IUPAC
1-O-benzyl 2-O-methyl (2S,4S)-4-aminopyrrolidine-1,2-dicarboxylate;hydrochloride
English name
(2S,4S)-1-CBZ-4-aMino Pyrrolidine-2-carboxylic acid Methylester-HCl
Molecular formula
C14H18N2O4.ClH
Molecular weight
314.77

Names & synonyms

1212395-57-71515919-15-9(2S,4S)-1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate hydrochloride207304-86-7(2S,4S)-1-CBZ-4-amino Pyrrolidine-2-carboxylic acid methylester-HClMethyl (2S,4S)-1-Cbz-4-aminopyrrolidine-2-carboxylate hydrochlorideMFCD068046281-benzyl 2-methyl (2S,4S)-4-aminopyrrolidine-1,2-dicarboxylate hydrochloride1-O-benzyl 2-O-methyl (2S,4S)-4-aminopyrrolidine-1,2-dicarboxylate;hydrochloride(2S, 4S)-4-Amino-1-[benzyloxycarbonyl]pyrrolidine-2-methylcarboxylate, HCl(2S,4S)-1-CBZ-4-amino Pyrrolidine-2-carboxylic acid methylester hydrochloride1,2-Pyrrolidinedicarboxylic acid, 4-amino-, 2-methyl 1-(phenylmethyl) ester, hydrochloride (1:1), (2S,4S)-
Show more names
(4S)-1-Cbz-4-amino-L-proline methyl ester HCl
METHYL (2S, 4S)-4-AMINO-1-CBZ-PYRROLIDINE-2-CARBOXYLATE HCLcis-1-Benzyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate hydrochlorideSCHEMBL30568418AC9170AR3905AKOS015846363AKOS015923393O1-benzyl O2-methyl (2S,4S)-4-aminopyrrolidine-1,2-dicarboxylate;hydrochloride

Database identifiers

CAS
1515919-15-9

Properties

Computed structural propertiesFilling in

Topological polar surface area
81.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
21
Formal charge
0
Complexity
355

Physicochemical properties

storage temp.
2 · under inert gas (nitrogen or Argon) at 2-8°C
Appearance
White Solid
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319-H335
Precautionary statements
P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes