Basic information
- CAS
607-60-3- Standard SMILES
CCCNc1cccc2ccccc12- InChIKey
WHOYKONBZHXCFI-UHFFFAOYSA-N- Molecular formula
- C13H15N
- Average molar mass
- 185.26 g/mol
- Monoisotopic mass
- 185.12044948
Names & identifiers
- Preferred name
- N-propylnaphthalen-1-amine
- IUPAC
- N-propylnaphthalen-1-amine
- English name
- NAPHTHALEN-1-YL-PROPYLAMINE
- Molecular formula
- C13H15N
- Molecular weight
- 185.27
Names & synonyms
N-propylnaphthalen-1-amine607-60-3DTXSID70323990RefChem:364885DTXCID70275107673-482-9Naphthalen-1-yl-propylamineNSC405386N-propylaminonaphthaleneOprea1_820908N-naphth-1-yl-N-propylamineSCHEMBL959196
Show more names
1-Naphthalenamine, N-propyl-
SCHEMBL1822754SCHEMBL5535936SCHEMBL18207447SCHEMBL27598715SCHEMBL31268310WHOYKONBZHXCFI-UHFFFAOYSA-NAAA60760AKOS000226157
Database identifiers
- CAS
607-60-3- PubChem CID
- 346980
- DTXSID
DTXSID70323990- EC Number
- 673-482-9
- Nikkaji
- J134.395E
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 167
Physicochemical properties
- Boiling point
- 322.448 · 322.448±11.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.053 · 1.053±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 5.04 · 5.040±0.20(predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers2 total
常州合晶化工有限公司85528066 13775048983 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
Related reactions
2 records
Compound notes
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