5-Methyl-1-hexyn-3-ol - CAS 61996-79-0
Catalog: |
BB031370 |
Product Name: |
5-Methyl-1-hexyn-3-ol |
CAS: |
61996-79-0 |
Synonyms: |
5-methylhex-1-yn-3-ol |
IUPAC Name: | 5-methylhex-1-yn-3-ol |
Description: | 5-Methyl-1-hexyn-3-ol (CAS# 61996-79-0) is a useful research chemical. |
Molecular Weight: | 112.17 |
Molecular Formula: | C7H12O |
Canonical SMILES: | CC(C)CC(C#C)O |
InChI: | InChI=1S/C7H12O/c1-4-7(8)5-6(2)3/h1,6-8H,5H2,2-3H3 |
InChI Key: | NTNUBJHPRAMQPC-UHFFFAOYSA-N |
Boiling Point: | 153.8 °C at 760 mmHg |
Purity: | > 98.0 % (GC) |
Density: | 0.889 g/cm3 |
MDL: | MFCD00041606 |
LogP: | 1.02660 |
GHS Hazard Statement: | H226 (100%): Flammable liquid and vapor [Warning Flammable liquids] |
Precautionary Statement: | P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P312, P303+P361+P353, P330, P370+P378, P403+P235, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111440591-A | Organosilicon conductive adhesive and preparation method thereof | 20190116 |
WO-2019232778-A1 | Curable silicone composition | 20180608 |
CN-112262034-A | Curable silicone composition | 20180608 |
KR-20210006943-A | Curable silicone composition | 20180608 |
EP-3817914-A1 | Curable silicone composition | 20180608 |
Complexity: | 96.2 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 112.088815002 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 112.088815002 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 20.2 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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