1,3-Dibromobutane - CAS 107-80-2
Catalog: |
BB002131 |
Product Name: |
1,3-Dibromobutane |
CAS: |
107-80-2 |
Synonyms: |
1,3-dibromobutane |
IUPAC Name: | 1,3-dibromobutane |
Description: | 1,3-Dibromobutane (CAS# 107-80-2) is a useful reagent in organic synthesis. |
Molecular Weight: | 215.91 |
Molecular Formula: | C4H8Br2 |
Canonical SMILES: | CC(CCBr)Br |
InChI: | InChI=1S/C4H8Br2/c1-4(6)2-3-5/h4H,2-3H2,1H3 |
InChI Key: | XZNGUVQDFJHPLU-UHFFFAOYSA-N |
Boiling Point: | 175 ℃ |
Purity: | 99 % |
Density: | 1.78 g/cm3 |
Appearance: | Clear colourless liquid |
MDL: | MFCD00000152 |
LogP: | 2.55480 |
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-112646558-A | Ecological safety sterilization corrosion inhibitor special for shale gas pipeline and preparation method thereof | 20201218 |
CN-111875637-A | Phosphine ligand and synthesis method and application thereof | 20200828 |
CN-111647073-A | Fluorescent probe and preparation method thereof | 20200703 |
CN-111689997-A | Metal complex, preparation method and application thereof | 20200618 |
WO-2021150574-A1 | Sulfonimidamide compounds as nlrp3 modulators | 20200122 |
Complexity: | 28.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 215.89723 |
Formal Charge: | 0 |
Heavy Atom Count: | 6 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 213.89928 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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