12-Mercaptododecanoic acid

• CAS: 82001-53-4
• Catalog Number: ACM82001534
• Category: Biomaterials
• Molecular Weight: 232.38g/mol
• Molecular Formula: C12H24O2S
• Synonyms: 12-Mercaptododecanoic acid ,97%;12-Mercaptododecanoic acid 96%
• IUPAC Name: 12-sulfanyldodecanoic acid
• Canonical SMILES: C(CCCCCC(=O)O)CCCCCS
• InChI: InChI=1S/C12H24O2S/c13-12(14)10-8-6-4-2-1-3-5-7-9-11-15/h15H,1-11H2,(H,13,14)
• InChI Key: SDAWVOFJSUUKMR-UHFFFAOYSA-N
• Complexity: 149
• Covalently-Bonded Unit Count: 1
• Exact Mass: 232.149701g/mol
• Formal Charge: 0
• H-Bond Acceptor: 3
• H-Bond Donor: 2
• Heavy Atom Count: 15
• Monoisotopic Mass: 232.149701g/mol
• Rotatable Bond Count: 11
• XLogP3: 4.6

Custom Q&A

What is the PubChem CID number for 12-Mercaptododecanoic acid?

The PubChem CID number for 12-Mercaptododecanoic acid is 566670.

What is the molecular formula of 12-Mercaptododecanoic acid?

The molecular formula of 12-Mercaptododecanoic acid is C12H24O2S.

What is the molecular weight of 12-Mercaptododecanoic acid?

The molecular weight of 12-Mercaptododecanoic acid is 232.38 g/mol.

What is the IUPAC name of 12-Mercaptododecanoic acid?

The IUPAC name of 12-Mercaptododecanoic acid is 12-sulfanyldodecanoic acid.

What is the InChIKey of 12-Mercaptododecanoic acid?

The InChIKey of 12-Mercaptododecanoic acid is SDAWVOFJSUUKMR-UHFFFAOYSA-N.

What is the CAS number of 12-Mercaptododecanoic acid?

The CAS number of 12-Mercaptododecanoic acid is 82001-53-4.

What is the XLogP3 value of 12-Mercaptododecanoic acid?

The XLogP3 value of 12-Mercaptododecanoic acid is 4.6.

How many hydrogen bond donor counts does 12-Mercaptododecanoic acid have?

12-Mercaptododecanoic acid has 2 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 12-Mercaptododecanoic acid have?

12-Mercaptododecanoic acid has 3 hydrogen bond acceptor counts.

How many rotatable bond counts does 12-Mercaptododecanoic acid have?

12-Mercaptododecanoic acid has 11 rotatable bond counts.