16-Heptadecyn-1-ol - CAS 62873-30-7
Catalog: |
BB064326 |
Product Name: |
16-Heptadecyn-1-ol |
CAS: |
62873-30-7 |
Synonyms: |
Heptadec-16-yn-1-ol; 16-Heptadecyne-1-ol |
IUPAC Name: | heptadec-16-yn-1-ol |
Description: | 16-Heptadecyn-1-ol is an intermediate in the synthesis of 16-Heptadecynoic Acid (H281295), which is a fatty acid chemical reagent used in the synthesis of CDC25A-inhibitory RE derivatives. 16-Heptadecyn-1-ol can also be used to synthesize long-chain, phenylene-modified α,ω-diols |
Molecular Weight: | 252.44 |
Molecular Formula: | C17H32O |
Canonical SMILES: | C#CCCCCCCCCCCCCCCCO |
InChI: | InChI=1S/C17H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18/h1,18H,3-17H2 |
InChI Key: | UJWWDCNQTPUQRZ-UHFFFAOYSA-N |
Solubility: | Dichloromethane, Methanol |
Appearance: | Off-White Solid |
References: | Tsuchiya, A. et al. Mol. BioSys., 9, 1026 (2013); Drescher, S., et al. RSC Adv., 2, 4052 (2012). |
Complexity: | 189 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 252.24531564 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 252.24531564 |
Rotatable Bond Count: | 14 |
Topological Polar Surface Area: | 20.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 6.8 |
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