Basic information
- CAS
13074-39-0- Standard SMILES
NC1C2CC3CC(C2)CC1C3- InChIKey
QZWNXXINFABALM-UHFFFAOYSA-N- Molecular formula
- C10H17N
- Average molar mass
- 151.25 g/mol
- Monoisotopic mass
- 151.13609955
Names & identifiers
- Preferred name
- 2-Aminoadamantane
- IUPAC
- adamantan-2-amine
- English name
- 2-Aminoadamantane
- Molecular formula
- C10H17N
- Molecular weight
- 151.25
Names & synonyms
2-aminoadamantane13074-39-0Tricyclo[3.3.1.13,7]decan-2-amineNSJ4EPG7F7NSC-127842DTXSID90156707Tricyclo(3.3.1.13,7)decan-2-amineRefChem:85358DTXCID4079198adamantan-2-amine2-Adamantanamine2-Adamantylamine
Show more names
Nsc 127842Adamantan-2-amine,95%2-Adamantanamine (8ci)Tricyclo[3.3.1.13,7]decan-2-ylamine
JP 60MFCD00078225adamantan-2-ylamineCHEMBL1170792adamantane-2-ylamineTricyclo(3.3.1.1(3,7))decan-2-amineF1928-00242-amino-adamantane
Database identifiers
- CAS
13074-39-0- PubChem CID
- 25332
- DTXSID
DTXSID90156707- ChEMBL
CHEMBL1170792- UNII
- NSJ4EPG7F7
- Nikkaji
- J261E
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 148
Physicochemical properties
- Melting point
- 230 · 230-236 °C
- Boiling point
- 226.1 · 226.1±8.0 °C(Predicted)
- Density
- 1.028 · 1.028±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- pka
- 10.85 · 10.85±0.20(Predicted)
- Appearance
- White to off-white Solid
- InChI
- InChI=1S/C10H17N/c11-10-8-2-6-1-7(4-8)5-9(10)3-6/h6-10H,1-5,11H2
- InChIKey
- QZWNXXINFABALM-UHFFFAOYSA-N
- SMILES
- C12CC3CC(CC(C3)C1N)C2
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HS Code
- 2902190000 · 2902190000
Safety & regulation
Safety data
- hs_code
- 2902190000
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
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Related reactions
58 records
Compound notes
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