2-Dodecylbutanedioic acid

HCID 62822CAS 455-95-8

Basic information

Standard SMILES
CCCCCCCCCCCCC(CC(=O)O)C(=O)O
InChIKey
YLAXZGYLWOGCBF-UHFFFAOYSA-N
Molecular formula
C16H30O4
Average molar mass
286.41 g/mol
Monoisotopic mass
286.21440944

Overview

blocking of the epsilon-amino group of the lysine residue in the bovine VIII/vWf complex by above cpd results in total loss of procoagulant activity; RN given refers to parent cpd

Names & identifiers

Preferred name
2-Dodecylbutanedioic acid
IUPAC
2-dodecylbutanedioic acid
English name
DODECYLSUCCINIC ACID
Molecular formula
C16H30O4
Molecular weight
286.41

Names & synonyms

Dodecylsuccinic acid2-dodecylbutanedioic acid455-95-81,2-tetradecanedicarboxylic acidDTXSID30963396RefChem:909787DTXCID601391147207-254-32-dodecylsuccinic acidButanedioic acid, dodecyl-DODECYLSUCCINICACIDEINECS 207-254-3
Show more names
2-laurylsuccinic acidButanedioic acid, 2-dodecyl-
SCHEMBL93428NS00042996

Database identifiers

CAS
455-95-8
PubChem CID
62822
DTXSID
DTXSID30963396
EC Number
207-254-3
Nikkaji
J22.523A

Properties

Computed structural properties

XLogP
5.6
Topological polar surface area
74.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
14
Heavy atoms
20

Physicochemical properties

Melting point
98 · 98-100 °C
Boiling point
400.9 · 400.9±18.0 °C(Predicted)
Density
1.014 · 1.014±0.06 g/cm3(Predicted)
pka
4.55 · 4.55±0.19(Predicted)

Chemistry & industry

Suppliers4 total

江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
成都卡麦尔医药科技有限公司028-67136579 15828051124 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

Related reactions

2 records

Linked notes

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