Basic information
- CAS
75214-12-9- Standard SMILES
COC(=O)CC(N)C(=O)NC(Cc1ccccc1)C(=O)OC.Cl- InChIKey
BJTWTXYXUWUNSU-UHFFFAOYSA-N- Molecular formula
- C15H21ClN2O5
- Average molar mass
- 344.79 g/mol
- Monoisotopic mass
- 344.1138995
Names & identifiers
- Preferred name
- Methyl 3-amino-4-[(1-benzyl-2-methoxy-2-oxoethyl)amino]-4-oxobutanoate hydrochloride
- IUPAC
- methyl 3-amino-4-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino]-4-oxobutanoate;hydrochloride
- English name
- Methyl 3-amino-4-[(1-benzyl-2-methoxy-2-oxoethyl)amino]-4-oxobutanoate hydrochloride
- Molecular formula
- C15H20N2O5.ClH
- Molecular weight
- 344.79
Names & synonyms
75214-12-9methyl 3-amino-4-[(1-benzyl-2-methoxy-2-oxoethyl)amino]-4-oxobutanoate hydrochloridemethyl 3-amino-4-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino]-4-oxobutanoate;hydrochlorideDTXSID70610074DB-074957METHYL 3-AMINO-4-[(1-BENZYL-2-METHOXY-2-OXOETHYL)AMINO]-4-OXOBUTANOATE HYDROCHLORIDE;Methyl3-amino-4-[(1-benzyl-2-methoxy-2-oxoethyl)amino]-4-oxobutanoateHCl;L-ASPARTYL-L-PHENYLALANINE DIMETHYL ESTER HYDROCHLORIDEMethyl 3-amino-4-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino]-4-oxobutanoate--hydrogen chloride (1/1)L-ASPARTYL-L-PHENYLALANINE DIMETHYL ESTER HYDROCHLORIDEMethyl3-amino-4-[(1-benzyl-2-methoxy-2-oxoethyl)amino]-4-oxobutanoateHCl
Database identifiers
- CAS
75214-12-9- PubChem CID
- 20849865
- DTXSID
DTXSID70610074
Properties
Computed structural properties
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 393
Physicochemical properties
- HS Code
- 2918199890 · 2918199890
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
- hs_code
- 2918199890
Chemistry & industry
Suppliers6 total
郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
上海海皋科技有限公司021-57646680 18306277365 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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