ChemicalBook--->CAS DataBase List--->59085-15-3

59085-15-3

59085-15-3 Structure

59085-15-3 Structure
IdentificationBack Directory
[Name]

4-(2-CARBOXYETHYL)-4-NITRO HEPTANEDIOIC ACID
[CAS]

59085-15-3
[Synonyms]

Nitrotriacid
RARECHEM AL BO 1279
LABOTEST-BB LT00645778
NITROMETHANETRISPROPIONIC ACID
Tris(2-carboxyethyl)nitromethane
1,1,1-Tris(2-carboxyethyl)nitromethane
4-(2-carboxyethyl)-4-nitropimelic acid
4-(2-CARBOXYETHYL)-4-NITRO HEPTANEDIOIC ACID
Heptanedioic acid, 4-(2-carboxyethyl)-4-nitro-
4-(2-Carboxyethyl)-4-nitroheptanedioic acid, 4-(2-Carboxyethyl)-4-nitropimelic acid, Tris(2-carboxyethyl)nitromethane
[Molecular Formula]

C10H15NO8
[MDL Number]

MFCD00077684
[MOL File]

59085-15-3.mol
[Molecular Weight]

277.23
Chemical PropertiesBack Directory
[Melting point ]

181-184 °C(lit.)
[Boiling point ]

570.4±50.0 °C(Predicted)
[density ]

1.456±0.06 g/cm3(Predicted)
[storage temp. ]

Store at room temperature
[form ]

solid
[pka]

3.75±0.10(Predicted)
[Appearance]

White to off-white Solid
[BRN ]

1804764
[InChI]

1S/C10H15NO8/c12-7(13)1-4-10(11(18)19,5-2-8(14)15)6-3-9(16)17/h1-6H2,(H,12,13)(H,14,15)(H,16,17)
[InChIKey]

JCMYUFMDOYGRKD-UHFFFAOYSA-N
[SMILES]

OC(=O)CCC(CCC(O)=O)(CCC(O)=O)[N+]([O-])=O
Questions And AnswerBack Directory
[Uses]

4-Nitro-4-(2-Carboxyethyl)pimelic acid is an organic intermediate that can be prepared in two steps from nitromethane and acrylonitrile. Literature reports that 4-nitro-4-(2-Carboxyethyl)pimelic acid can be used to prepare porphyrin dendritic macromolecules and Behera amines. Behera amines can simultaneously link with three equivalents via amide bonds to obtain second- and even third-generation compounds, making them widely used in dendritic polymers.
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Spectrum DetailBack Directory
[Spectrum Detail]

4-(2-CARBOXYETHYL)-4-NITRO HEPTANEDIOIC ACID(59085-15-3)1HNMR
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