1-Tetradecanethiol

• CAS: 2079-95-0
• Catalog Number: ACM2079950
• Category: Biomaterials
• Molecular Weight: 230.46g/mol
• Molecular Formula: C14H30S
• Synonyms: 1-TETRADECANETHIOL;1-Mercaptotetradecane;n-tetradecanethiol;Tetradecanethiol-(1);tetradecanethiol(non-specificname);tetradecanethiolnormal;TETRADECYLMERCAPTAN;TETRADECANE THIOL
• IUPAC Name: tetradecane-1-thiol
• Canonical SMILES: CCCCCCCCCCCCCCS
• InChI: InChI=1S/C14H30S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h15H,2-14H2,1H3
• InChI Key: GEKDEMKPCKTKEC-UHFFFAOYSA-N
• Complexity: 102
• Covalently-Bonded Unit Count: 1
• EC Number: 218-209-2
• Exact Mass: 230.206822g/mol
• Formal Charge: 0
• H-Bond Acceptor: 1
• H-Bond Donor: 1
• Heavy Atom Count: 15
• Monoisotopic Mass: 230.206822g/mol
• NSC Number: 57865
• Rotatable Bond Count: 12
• UNII: APY3P7S1XM
• XLogP3: 7.2

Custom Q&A

What is the molecular formula of 1-Tetradecanethiol?

The molecular formula of 1-Tetradecanethiol is C14H30S.

What is the molecular weight of 1-Tetradecanethiol?

The molecular weight of 1-Tetradecanethiol is 230.46 g/mol.

What is the IUPAC name of 1-Tetradecanethiol?

The IUPAC name of 1-Tetradecanethiol is tetradecane-1-thiol.

What is the unique identifier assigned to 1-Tetradecanethiol by PubChem?

The unique identifier assigned to 1-Tetradecanethiol by PubChem is CID 64677.

What is the InChIKey of 1-Tetradecanethiol?

The InChIKey of 1-Tetradecanethiol is GEKDEMKPCKTKEC-UHFFFAOYSA-N.

What is the CAS number of 1-Tetradecanethiol?

The CAS number of 1-Tetradecanethiol is 2079-95-0.

What is the XLogP3 value of 1-Tetradecanethiol?

The XLogP3 value of 1-Tetradecanethiol is 7.2.

How many hydrogen bond donor counts are there in 1-Tetradecanethiol?

There is 1 hydrogen bond donor count in 1-Tetradecanethiol.

How many rotatable bond counts are there in 1-Tetradecanethiol?

There are 12 rotatable bond counts in 1-Tetradecanethiol.

Is 1-Tetradecanethiol a canonicalized compound?

Yes, 1-Tetradecanethiol is a canonicalized compound.