Basic information
- CAS
4230-33-5- Standard SMILES
Nc1ccc(C(=O)NC(CCC(=O)O)C(=O)O)cc1- InChIKey
GADGMZDHLQLZRI-UHFFFAOYSA-N- Molecular formula
- C12H14N2O5
- Average molar mass
- 266.25 g/mol
- Monoisotopic mass
- 266.09027155
Overview
2-[(4-Aminobenzoyl)amino]pentanedioic acid is a glutamic acid derivative.
Names & identifiers
- Preferred name
- 2-((4-Aminobenzoyl)amino)pentanedioic acid
- IUPAC
- 2-[(4-aminobenzoyl)amino]pentanedioic acid
- English name
- N-(4-Aminobenzoyl)-DL-glutamic acid
- Molecular formula
- C12H14N2O5
- Molecular weight
- 266.25
Names & synonyms
2-[(4-aminobenzoyl)amino]pentanedioic acid2-((4-Aminobenzoyl)amino)pentanedioic acidRefChem:10605234230-33-5N-(4-Aminobenzoyl)-DL-Glutamic acid2-(4-Aminobenzamido)pentanedioic acidGlutamic acid, N-(4-aminobenzoyl)-(4-AMINOBENZOYL)GLUTAMIC ACID4-aminobenzoyl-l-glutamic acidFolinic Acid Impurity 6N-(4-Aminobenzoyl)glutamic acidaminobenzoyl-glutamate
Show more names
2-[(4-aminobenzoyl)amino]pentanedioicaci2-[(4-aminophenyl)formamido]pentanedioic acidN-(4-Aminobenzoyl)-DL-glutamic acid USP/EP/BP2-[(4-Aminobenzoyl)amino]pentane-1,5-dioic acid, 1-[(4-Aminobenzoyl)amino]propane-1,3-dicarboxylic acid
NCIOpen2_003503SCHEMBL80299DTXSID10871066CHEBI:182011ALBB-033728NSC71042N-(4-Aminobenzoyl)-DL-glutamicacid2-(4-Aminobenzamido)pentanedioicacid
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 130 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 350
Physicochemical properties
- Boiling point
- 607.078 · 607.078±55.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.418 · 1.418
- pka
- 3.602 · 3.602±0.10(predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H335
- Precautionary statements
- 280 · P280-P271
- HazardClass
- IRRITANT
- HS Code
- 2924297099 · 2924297099
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
- hs_code
- 2924297099
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302+H312+H332-H315-H319-H335
- Precautionary statements
- P280-P271
Chemistry & industry
Suppliers17 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
江苏洪珉药业有限公司18221292452 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
河南奥创化工有限公司+86-0371-63689365 +8618638391208 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
上海源香科生物科技有限公司13248186658 · [email protected]
武汉卡米克科技有限公司18162538168 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 17389186172 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
重庆卡兰医药有限公司[email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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