4-Amino-4-methylpentanoic acid
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Basic information
- CAS
3235-46-9- Standard SMILES
CC(C)(N)CCC(=O)O- InChIKey
FZNOWMWZNCOYIJ-UHFFFAOYSA-N- Molecular formula
- C6H13NO2
- Average molar mass
- 131.17 g/mol
- Monoisotopic mass
- 131.09462866
Names & identifiers
- Preferred name
- 4-Amino-4-methylpentanoic acid
- IUPAC
- 4-amino-4-methylpentanoic acid
- English name
- NSC20667
- Molecular formula
- C6H13NO2
- Molecular weight
- 131.17
Names & synonyms
4-amino-4-methylpentanoic acid3235-46-9NSC20667pentanoic acid, 4-amino-4-methyl-MFCD09036517MFCD14705632Pentanoic acid, 4-amino-4-methyl-, hydrochlorideNSC-206674-amino-4-methylpentanoicacid4-amino-4-methyl-valeric acidSCHEMBL19332864-amino-4-methyl-pentanoic acid
Show more names
4-Amino-4-methylpentanoic acid hydrochloride4-amino-4-methylpentanoic acid(SALTDATA: HCl)
DTXSID20281177FZNOWMWZNCOYIJ-UHFFFAOYSA-NALBB-0161574-Amino-4-methylpentanoic acid HCl4-amino-4,4-dimethyl butanoic acidSBB019066STK694725AKOS000320168
Database identifiers
- CAS
3235-46-9- PubChem CID
- 228069
- DTXSID
DTXSID20281177- Nikkaji
- J623.483F
Properties
Computed structural propertiesFilling in
- XLogP
- -2.5
- Topological polar surface area
- 63.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 110
Physicochemical properties
- storage temp.
- 2 · 2-8°C
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HazardClass
- IRRITANT
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
3 records
Compound notes
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