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Structure

(+/-)-Alpha-lipoamide

CAS
940-69-2
Catalog Number
ACM940692
Category
Other Products
Molecular Weight
205.34
Molecular Formula
C8H15NOS2

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Specification

Synonyms
DL-Thioctamide
IUPAC Name
5-(Dithiolan-3-yl)pentanamide
Canonical SMILES
C1CSSC1CCCCC(=O)N
InChI
InChI=1S/C8H15NOS2/c9-8(10)4-2-1-3-7-5-6-11-12-7/h7H,1-6H2,(H2,9,10)
InChI Key
FCCDDURTIIUXBY-UHFFFAOYSA-N
Boiling Point
399.2±11.0 °C
Melting Point
127-129 °C(lit.)
Flash Point
195.2 °C
Density
1.1989 g/cm³
Appearance
Solid
Storage
Sealed in dry, 2-8 °C
Complexity
152
Exact Mass
205.05950645
Monoisotopic Mass
205.05950645
pKa
16.59±0.40(Predicted)
Refractive Index
1.5364
Topological Polar Surface Area
93.7 Ų
What is the molecular formula of lipoamide?

The molecular formula of lipoamide is C8H15NOS2.

What is the molecular weight of lipoamide?

The molecular weight of lipoamide is 205.3 g/mol.

What is the IUPAC name of lipoamide?

The IUPAC name of lipoamide is 5-(dithiolan-3-yl)pentanamide.

What is the InChI of lipoamide?

The InChI of lipoamide is InChI=1S/C8H15NOS2/c9-8(10)4-2-1-3-7-5-6-11-12-7/h7H,1-6H2,(H2,9,10).

What is the InChIKey of lipoamide?

The InChIKey of lipoamide is FCCDDURTIIUXBY-UHFFFAOYSA-N.

What is the canonical SMILES of lipoamide?

The canonical SMILES of lipoamide is C1CSSC1CCCCC(=O)N.

What is the CAS number of lipoamide?

The CAS number of lipoamide is 940-69-2.

What is the ChEMBL ID of lipoamide?

The ChEMBL ID of lipoamide is CHEMBL1403899.

How many hydrogen bond donor counts does lipoamide have?

Lipoamide has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does lipoamide have?

Lipoamide has 3 hydrogen bond acceptor counts.

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