Basic information
- CAS
1011-60-5- Standard SMILES
NC(CCC(=O)O)c1ccccc1- InChIKey
QCHLDIVWWGHNQB-UHFFFAOYSA-N- Molecular formula
- C10H13NO2
- Average molar mass
- 179.22 g/mol
- Monoisotopic mass
- 179.09462866
Names & identifiers
- Preferred name
- 4-Amino-4-phenylbutanoic acid
- IUPAC
- 4-amino-4-phenylbutanoic acid
- English name
- 4-amino-4-phenyl-butanoic acid
- Molecular formula
- C10H13NO2
- Molecular weight
- 179.22
Names & synonyms
4-amino-4-phenylbutanoic acid1011-60-5BUTYRIC ACID, 4-AMINO-4-PHENYL-GBD7C6WGX2NSC-230421DTXSID501307224RefChem:1070269DTXCID2017371674-Amino-4-phenyl-butyric acid4-amino-4-phenyl-butanoic acidMFCD00844723Benzenebutanoic acid, gamma-amino-
Show more names
γ-Aminobenzenebutyric acidg-Amino-benzenebutanoic acid
(R)-4-Amino-4-phenyl-butyric acidgamma-Phenyl GABA4-Amino-4-phenylbutyric acid(S)-4-Amino-4-phenyl-butyric acidNSC 230421BRN 2720548(S)-4-Amino-4-phenylbutyric acidNSC230421
Database identifiers
- CAS
1011-60-5- PubChem CID
- 13893
- DTXSID
DTXSID501307224- UNII
- GBD7C6WGX2
- Nikkaji
- J13.532A
Properties
Computed structural properties
- XLogP
- -1.6
- Topological polar surface area
- 63.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 164
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
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 statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers8 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
吉尔多肽生物制药（大连市）有限公司021-61263455 13167021076 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
滨海吉尔多肽有限公司021-61263389 13524856427 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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