Basic information
- CAS
635-91-6- Standard SMILES
NC(CC(=O)O)C(=O)Nc1ccc2ccccc2c1- InChIKey
YRMVHTZHFWHHIU-UHFFFAOYSA-N- Molecular formula
- C14H14N2O3
- Average molar mass
- 258.27 g/mol
- Monoisotopic mass
- 258.10044231
Names & identifiers
- Preferred name
- Aspartic acid beta-naphthylamide
- IUPAC
- 3-amino-4-(naphthalen-2-ylamino)-4-oxobutanoic acid
- English name
- L-Aspartic acid alpha-(beta-naphthylamide)
- Molecular formula
- C14H14N2O3
- Molecular weight
- 258.27
Names & synonyms
Asp-beta-naphthylamideAlpha-Asp-naphthylamideAspNNapAsp-NARefChem:114688Aspartic acid beta-naphthylamideN1-2-Naphthyl-alpha-asparagine17139-56-93-amino-4-(naphthalen-2-ylamino)-4-oxobutanoic acidN~1~-2-naphthyl-alpha-asparagineH-Asp-betaNAMFCD09763728
Show more names
H-Asp-bNAH-Asp-βNAL-Asp-βNAH-ASP-BETA-NAL-ASPARTYL-B-NAPHTHYLAMIDEL-Aspartic acid β-naphthylamideL-ASPARTIC ACID A-(B-NAPHTHYLAMIDE)ALPHA-L-ASPARTYL-BETA-NAPHTHYLAMIDEL-ASPARTIC ACID α-(β-NAPHTHYLAMIDE)
3-AMINO-3-[(NAPHTHALEN-2-YL)CARBAMOYL]PROPANOIC ACIDL-aspartic acid beta-naphthylamideDTXSID40979721ALBB-023505EINECS 211-243-9AKOS003399434LS-07404ST104908
Database identifiers
- CAS
635-91-6- PubChem CID
- 102456
- DTXSID
DTXSID40979721
Properties
Computed structural properties
- XLogP
- -1.3
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 346
Physicochemical properties
- Boiling point
- 567.8 · 567.8±45.0 °C(Predicted)
- Density
- 1.371 · 1.371±0.06 g/cm3(Predicted)
- storage temp.
- 0 · Store at 0-5°C
- pka
- 3.72 · 3.72±0.10(Predicted)
- Symbol(GHS)
- 8 · GHS08
- Signal word
- Warning
- Hazard statements
- 351 · H351
- Precautionary statements
- 201 · P201-P202-P281-P308+P313-P405-P501
- Hazard Codes
- Xn
- Risk Statements
- 40 · 40
- Safety Statements
- 22 · 22-36
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
- risk_code
- 40
- Signal word
- Warning
- Symbol(GHS)
- GHS08
- hazard_code
- Xn
- safety_code
- 22-36
- Hazard statements
- H351
- Precautionary statements
- P201-P202-P281-P308+P313-P405-P501
Chemistry & industry
Suppliers7 total
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
江苏洪珉药业有限公司18221292452 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
宝鸡缔都医药化工有限公司029-029-81148929 17792602132 · [email protected]
Additional notes
DefinitionChEBI: An L-aspartic acid derivative that is the amide obtained by formal condensation of the alpha-carboxy group of L-aspartic acid with the amino group of 2-naphthylamine.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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