Basic information
- CAS
74292-78-7- Standard SMILES
NCC(=O)NCC(=O)NC(Cc1ccccc1)C(=O)O- InChIKey
KAJAOGBVWCYGHZ-UHFFFAOYSA-N- Molecular formula
- C13H17N3O4
- Average molar mass
- 279.29 g/mol
Names & identifiers
- Preferred name
- N-(N-Glycylglycyl)-3-phenyl-DL-alanine
- IUPAC
- 2-[[2-[(2-aminoacetyl)amino]acetyl]amino]-3-phenylpropanoic acid
- English name
- N-(N-glycylglycyl)-3-phenyl-DL-alanine
- Molecular formula
- C13H17N3O4
- Molecular weight
- 279.29
Names & synonyms
74292-78-7N-(N-Glycylglycyl)-3-phenyl-DL-alanineEINECS 277-802-4RefChem:362792277-802-42-[[2-[(2-aminoacetyl)amino]acetyl]amino]-3-phenylpropanoic acid2-(2-(2-Aminoacetamido)acetamido)-3-phenylpropanoic acidGlycylglycyl-D,L-PhenylalanineGlycyl-glycyl-L-phenylalanineGly-Gly-Phe-OHNSC163324CHEMBL350167
Show more names
H-Gly-Gly-DL-Phe-OHPhenylalanine,glycylglycyl-N-(N-Glycylglycyl)-DL-phenylalanine
SCHEMBL2032501DTXSID50995816KAJAOGBVWCYGHZ-UHFFFAOYSA-NBDBM50085084AKOS010405304NSC-163324DB-054135ST50409290
Database identifiers
- CAS
74292-78-7- PubChem CID
- 294564
- DTXSID
DTXSID50995816- EC Number
- 277-802-4
Properties
Computed structural properties
- XLogP
- -3.1
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 354
Physicochemical properties
- Boiling point
- 647.1 · 647.1±55.0 °C(Predicted)
- Density
- 1.296 · 1.296±0.06 g/cm3(Predicted)
- pka
- 3.47 · 3.47±0.10(Predicted)
Safety & regulation
GHS classification
GHS Classification
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.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Chemistry & industry
Suppliers3 total
滨海吉尔多肽有限公司021-61263389 13524856427 · [email protected]
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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