Basic information
- CAS
4467-67-8- Standard SMILES
COc1cc(NC(=O)[C@H](C)N)cc2ccccc12- InChIKey
HHHWOVLNFWAAAF-VIFPVBQESA-N- Molecular formula
- C14H16N2O2
- Average molar mass
- 244.29 g/mol
- Monoisotopic mass
- 244.12117776
Overview
See also: L-Alanine 4-methoxy-b-naphthylamide free base (annotation moved to).
Names & identifiers
- Preferred name
- (2S)-2-amino-N-(4-methoxynaphthalen-2-yl)propanamide
- IUPAC
- (2S)-2-amino-N-(4-methoxynaphthalen-2-yl)propanamide
- English name
- L-Alanine 4-methoxy-beta-naphthylamide
- Molecular formula
- C14H16N2O2
- Molecular weight
- 244.29
Names & synonyms
4467-67-8(2S)-2-amino-N-(4-methoxynaphthalen-2-yl)propanamideN-(4-Methoxynaphthalen-2-yl)-L-alaninamideL-alanine 4-methoxy-B-naphthylamide*free baseSCHEMBL7738208DTXSID30350888l-alanine-4-methoxy-2-naphthylamideH-Ala-4MbNAH-ALA-4M-BETANAALANINE-4M-BETANAH-Ala-4M.beta.NA (free base)l-alanine 4-methoxy-β-naphthylamide
Show more names
L-Alanine 4-methoxy-beta-naphthylamidePropanamide, 2-amino-N-(4-methoxy-2-naphthalenyl)-, (2S)-
Database identifiers
- CAS
4467-67-8- PubChem CID
- 688367
- DTXSID
DTXSID30350888- Nikkaji
- J673.562B
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 64.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 296
Physicochemical properties
- storage temp.
- 20 °C · −20°C
- 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
- WGK Germany
- 3 · 3
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
- wgk
- 3
- 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
Suppliers1 total
江苏洪珉药业有限公司18221292452 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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