4-Chlorobenzaldehyde dimethyl acetal - CAS 3395-81-1
Catalog: |
BB021911 |
Product Name: |
4-Chlorobenzaldehyde dimethyl acetal |
CAS: |
3395-81-1 |
Synonyms: |
1-chloro-4-(dimethoxymethyl)benzene |
IUPAC Name: | 1-chloro-4-(dimethoxymethyl)benzene |
Description: | 4-Chlorobenzaldehyde dimethyl acetal (CAS# 3395-81-1 ) is a useful research chemical. |
Molecular Weight: | 186.64 |
Molecular Formula: | C9H11ClO2 |
Canonical SMILES: | COC(C1=CC=C(C=C1)Cl)OC |
InChI: | InChI=1S/C9H11ClO2/c1-11-9(12-2)7-3-5-8(10)6-4-7/h3-6,9H,1-2H3 |
InChI Key: | YRNBYTFFWMWTGG-UHFFFAOYSA-N |
Boiling Point: | 114-115 °C / 19 mmHg (lit.) |
Density: | 1.128 g/cm3 |
MDL: | MFCD00045210 |
LogP: | 2.63140 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P312, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-106279264-A | A kind of preparation method of α alkoxyl p-chlorobenzyl phosphonate ester | 20160816 |
CN-106279264-B | A kind of preparation method of alpha-alkoxy base p-chlorobenzyl phosphonate ester | 20160816 |
CN-106279275-A | A kind of process for catalytic synthesis of α alkoxyl p-chlorobenzyl phosphonate ester | 20160816 |
WO-2018029264-A1 | Process for preparation of dapagliflozin and intermediates thereof | 20160810 |
CN-104230879-A | Simple and convenient preparation method of 2-((4R,6S)-6-formyl-2,2-disubstituted-1,3-dioxane-4-yl)acetate | 20140815 |
Complexity: | 118 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.0447573 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.0447573 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 18.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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