Basic information
- Standard SMILES
CCCCNC(=O)c1cccc2ccccc12- InChIKey
YSXQPIVYBHSMBS-UHFFFAOYSA-N- Molecular formula
- C15H17NO
- Average molar mass
- 227.3 g/mol
- Monoisotopic mass
- 227.13101416
Names & identifiers
- Preferred name
- N-butylnaphthalene-1-carboxamide
- IUPAC
- N-butylnaphthalene-1-carboxamide
- English name
- N-Butylnaphthalene-1-carboxamide
- Molecular formula
- C15H17NO
- Molecular weight
- 227.3
Names & synonyms
N-butylnaphthalene-1-carboxamide54751-78-9DTXSID30343932RefChem:363621DTXCID30295008n-Butyl-1-naphthamide1-Naphthalenecarboxamide, N-butyl-N-butylnaphthylcarboxamiden-Butyl-1-naphthamide #SCHEMBL1093718SCHEMBL5110116SCHEMBL5110122
Show more names
N-Butyl-1-naphthalenecarboxamide
SCHEMBL30301313YSXQPIVYBHSMBS-UHFFFAOYSA-NSTK375484AKOS003052449NCGC00341834-01DB-321034ST50450634AB01334468-02
Database identifiers
- CAS
54751-78-9- PubChem CID
- 593299
- DTXSID
DTXSID30343932- Nikkaji
- J122.351H
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 251
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335-H411
- Precautionary statements
- 261 · P261-P273-P281-P302+P352-P304+P340-P305+P351+P338
- RIDADR
- 3077 · UN3077
- HazardClass
- 9 · 9
- Limited Quantities
- 5 L · 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Safety & regulation
Safety data
- ridadr
- UN3077
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- hazard_class
- 9
- Hazard statements
- H302-H315-H319-H335-H411
- Limited Quantities
- 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
- Precautionary statements
- P261-P273-P281-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Suppliers1 total
郑州康弗辰医药科技有限公司18210788515; 18210788515 · [email protected]
Related reactions
1 records
Linked notes
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