2-[(Butan-2-yl)amino]acetic acid
Basic information
- CAS
58695-42-4- Standard SMILES
CCC(C)NCC(=O)O- InChIKey
IVCQRTJVLJXKKJ-UHFFFAOYSA-N- Molecular formula
- C6H13NO2
- Average molar mass
- 131.17 g/mol
- Monoisotopic mass
- 131.09462866
Names & identifiers
- Preferred name
- 2-[(Butan-2-yl)amino]acetic acid
- IUPAC
- 2-(butan-2-ylamino)acetic acid
- English name
- N-isobutyrylglycine
- Molecular formula
- C6H13NO2
- Molecular weight
- 131.17
Names & synonyms
2-[(butan-2-yl)amino]acetic acidsec-butylglycineN-Butan-2-ylglycineN-(s-butyl)-glycineN-sec. Butyl GlycineN-(Butan-2-yl)glycineSCHEMBL164712SCHEMBL28096129DTXSID90974221IVCQRTJVLJXKKJ-UHFFFAOYSA-N2-[(butan-2-yl)amino]aceticacidMFCD11185544
Show more names
Glycine, N-(1-methylpropyl)-
AKOS009234845EN300-49599H84074
Database identifiers
- CAS
58695-42-4- PubChem CID
- 42811
- DTXSID
DTXSID90974221- Nikkaji
- J1.621.274A
Properties
Computed structural properties
- XLogP
- -1.6
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 93.1
Chemistry & industry
Upstream & downstream products
Upstream raw materials
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Related reactions
1 records
Compound notes
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