3-(Bromoacetyl)thiophene - CAS 1468-82-2
Catalog: |
BB010131 |
Product Name: |
3-(Bromoacetyl)thiophene |
CAS: |
1468-82-2 |
Synonyms: |
2-bromo-1-thiophen-3-ylethanone |
IUPAC Name: | 2-bromo-1-thiophen-3-ylethanone |
Description: | 3-(Bromoacetyl)thiophene (CAS# 1468-82-2) is a useful research chemical. |
Molecular Weight: | 205.07 |
Molecular Formula: | C6H5BrOS |
Canonical SMILES: | C1=CSC=C1C(=O)CBr |
InChI: | InChI=1S/C6H5BrOS/c7-3-6(8)5-1-2-9-4-5/h1-2,4H,3H2 |
InChI Key: | TXEJYUFJFSPCHH-UHFFFAOYSA-N |
Boiling Point: | 247.5 °C at 760 mmHg |
Melting Point: | 61 °C |
Purity: | 95 % |
Density: | 1.658 g/cm3 |
Appearance: | Off-white solid. |
LogP: | 2.32570 |
GHS Hazard Statement: | H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111384398-A | Composite conductive adhesive suitable for silicon-based negative electrode of lithium ion battery | 20181229 |
EP-3556756-A1 | Substituted propanamides as inhibitors of nucleases | 20180417 |
WO-2019201867-A1 | Substituted propanamides as inhibitors of nucleases | 20180417 |
AU-2019256672-A1 | Substituted propanamides as inhibitors of nucleases | 20180417 |
EP-3556756-B1 | Substituted propanamides as inhibitors of nucleases | 20180417 |
Complexity: | 116 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 203.92445 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 203.92445 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 45.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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