2-Methylene-1,3-propanediol - CAS 3513-81-3
Catalog: |
BB022493 |
Product Name: |
2-Methylene-1,3-propanediol |
CAS: |
3513-81-3 |
Synonyms: |
2-methylenepropane-1,3-diol; 2-methylidenepropane-1,3-diol |
IUPAC Name: | 2-methylidenepropane-1,3-diol |
Description: | 2-Methylene-1,3-propanediol (CAS# 3513-81-3) is a useful research chemical. |
Molecular Weight: | 88.11 |
Molecular Formula: | C4H8O2 |
Canonical SMILES: | C=C(CO)CO |
InChI: | InChI=1S/C4H8O2/c1-4(2-5)3-6/h5-6H,1-3H2 |
InChI Key: | JFFYKITVXPZLQS-UHFFFAOYSA-N |
Boiling Point: | 93-95 °C / 2 mmHg (lit.) |
Flash Point: | 230.0 °CF - closed cup |
Purity: | 97 % |
Density: | 1.081 g/mL at 25 °C (lit.) |
MDL: | MFCD00075162 |
LogP: | -0.47280 |
Refractive Index: | n20/D 1.473 (lit.) |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112191198-A | Isobutylene oxyacetylation reaction device and method | 20201111 |
CN-112341314-A | Method for preparing 2-methyl-1, 3-propylene glycol from isobutene | 20201111 |
CN-111718488-A | Single-ended dihydroxy alkyl silicone oil for polyurethane modification and preparation method thereof | 20200806 |
JP-2021143201-A | Physical property stabilizer for water-based cosmetics | 20200410 |
WO-2021206072-A1 | Resin composition, and film and multilayer structure body using same | 20200410 |
PMID | Publication Date | Title | Journal |
15228292 | 20040708 | Conformationally constrained analogues of diacylglycerol. 24. Asymmetric synthesis of a chiral (R)-DAG-lactone template as a versatile precursor for highly functionalized DAG-lactones | Organic letters |
15064804 | 20040421 | Preparation and antiviral properties of new acyclic, achiral nucleoside analogues: 1- or 9-[3-hydroxy-2-(hydroxymethyl)prop-1-enyl]nucleobases and 1- or 9-[2,3-dihydroxy-2-(hydroxymethyl)propyl]nucleobases | Organic & biomolecular chemistry |
11300904 | 20010323 | Synthesis of a fluorinated analogue of anticancer active ether lipids | The Journal of organic chemistry |
Complexity: | 43.5 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 88.052429494 |
Formal Charge: | 0 |
Heavy Atom Count: | 6 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 88.052429494 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 40.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.4 |
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