Basic information
- CAS
10466-72-5- Standard SMILES
O=C(O)CCCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]- InChIKey
ZYUWUKIAUDIXCQ-UHFFFAOYSA-N- Molecular formula
- C12H15N3O6
- Average molar mass
- 297.26 g/mol
- Monoisotopic mass
- 297.09608521
Overview
N-(2,4-dinitrophenyl)aminohexanoic acid is a C-nitro compound comprising hexanoic acid with a (2,4-dinitrophenyl)amino substituent at position C-6. It is functionally related to a 6-aminohexanoic acid.
Names & identifiers
- Preferred name
- Dinitrophenyl-epsilon-aminocaproic acid
- IUPAC
- 6-(2,4-dinitroanilino)hexanoic acid
- English name
- N-(2,4-Dinitrophenyl)-6-aminohexanoic acid
- Molecular formula
- C12H15N3O6
- Molecular weight
- 297.26
Names & synonyms
10466-72-5Dnp-aminocaproic acid6-N-(2,4-Dinitrophenyl)aminohexanoic acidDTXSID20146636Hexanoic acid, 6-((2,4-dinitrophenyl)amino)-RefChem:920365DTXCID0069127Dinitrophenyl-epsilon-aminocaproic acidDNP-X acid6-((2,4-Dinitrophenyl)amino)hexanoic acidN-(2,4-Dinitrophenyl)-6-aminohexanoic Acid6-(2,4-dinitroanilino)hexanoic acid
Show more names
IFLAB-BB F0131-0025DNP-X acid, 10 mM in DMSON-DNP-6-AMINOHEXANOIC ACID6-(Dnp-Amino)hexanoic acidDNP-EPSILON-AMINOCAPROIC ACIDN-2,4-DNP-E-AMINO-N-CAPROICACIDN-2,4-DNP-EPSILON-AMINO-N-CAPROIC ACID
DNP-Cap6-[(2,4-dinitrophenyl)amino]hexanoic acidDnp-epsilon-aminocaproateMFCD00038470N-(2,4-dinitrophenyl)aminohexanoic acidC9DMK9DA99DNP-epsilon-amino-n-caproic acidNSC-89627
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 141 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 378
Physicochemical properties
- Melting point
- 133 °C · 133 °C
- Boiling point
- 532.5 · 532.5±50.0 °C(Predicted)
- Density
- 1.417 · 1.417±0.06 g/cm3(Predicted)
- storage temp.
- 20 °C · −20°C
- pka
- 4.75 · 4.75±0.10(Predicted)
- form
- powder to crystal
- color
- Light yellow to Yellow to Orange
- CAS DataBase Reference
- 10466 · 10466-72-5(CAS DataBase Reference)
- FDA UNII
- 9 DMK9DA99 · C9DMK9DA99
- Symbol(GHS)
- 2 · GHS02
- Signal word
- Warning
- Hazard statements
- 228 · H228
- Precautionary statements
- 210 · P210-P240-P241-P280
- WGK Germany
- 3 · 3
- HS Code
- 2922.49 · 2922.49.3700
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
- wgk
- 3
- hs_code
- 2922.49.3700
- Signal word
- Warning
- Symbol(GHS)
- GHS02
- Hazard statements
- H228
- Precautionary statements
- P210-P240-P241-P280
Chemistry & industry
Applications
UsesN-(2,4-Dinitrophenyl)-6-aminohexanoic Acid is used as an analyte in microfluidic chips.
Suppliers42 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
重庆欣博曜生物科技有限公司19122915778 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海泰坦科技股份有限公司4006009262 13023226327 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
Creative Peptides[email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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