4-(2-Bromoethoxy)benzaldehyde - CAS 52191-15-8
Catalog: |
BB027735 |
Product Name: |
4-(2-Bromoethoxy)benzaldehyde |
CAS: |
52191-15-8 |
Synonyms: |
4-(2-bromoethoxy)benzaldehyde; 4-(2-bromoethoxy)benzaldehyde |
IUPAC Name: | 4-(2-bromoethoxy)benzaldehyde |
Description: | 4-(2-Bromoethoxy)benzaldehyde (CAS# 52191-15-8) is a useful research chemical. |
Molecular Weight: | 229.07 |
Molecular Formula: | C9H9BrO2 |
Canonical SMILES: | C1=CC(=CC=C1C=O)OCCBr |
InChI: | InChI=1S/C9H9BrO2/c10-5-6-12-9-3-1-8(7-11)2-4-9/h1-4,7H,5-6H2 |
InChI Key: | XFHTVCMRNSBQCF-UHFFFAOYSA-N |
Boiling Point: | 327.9 ℃ at 760 mmHg |
Density: | 1.479 g/cm3 |
MDL: | MFCD00021074 |
LogP: | 2.27280 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P272, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P333+P313, P337+P313, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
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Complexity: | 131 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 227.97859 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 227.97859 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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