2,2-Dimethylbenzo[d][1,3]dioxole-4-carbaldehyde - CAS 134817-17-7
Catalog: |
BB008019 |
Product Name: |
2,2-Dimethylbenzo[d][1,3]dioxole-4-carbaldehyde |
CAS: |
134817-17-7 |
Synonyms: |
2,2-dimethyl-1,3-benzodioxole-4-carboxaldehyde; 2,2-dimethyl-1,3-benzodioxole-4-carbaldehyde |
IUPAC Name: | 2,2-dimethyl-1,3-benzodioxole-4-carbaldehyde |
Description: | 2,2-Dimethylbenzo[d][1,3]dioxole-4-carbaldehyde (CAS# 134817-17-7) is a useful research chemical. |
Molecular Weight: | 178.18 |
Molecular Formula: | C10H10O3 |
Canonical SMILES: | CC1(OC2=CC=CC(=C2O1)C=O)C |
InChI: | InChI=1S/C10H10O3/c1-10(2)12-8-5-3-4-7(6-11)9(8)13-10/h3-6H,1-2H3 |
InChI Key: | RMOKRPOMUJFXSE-UHFFFAOYSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
AU-2006287976-A1 | Novel diazaspiroalkanes and their use for treatment of CCR8 mediated diseases | 20050906 |
BR-PI0615634-A2 | new diazaspiro compounds | 20050906 |
CA-2621187-A1 | Novel diazaspiroalkanes and their use for treatment of ccr8 mediated diseases | 20050906 |
CN-101305005-A | Novel diazaspiroalkanes and their use for treatment of CCR8 mediated diseases | 20050906 |
EP-1926730-A1 | Novel diazaspiroalkanes and their use for treatment of ccr8 mediated diseases | 20050906 |
Complexity: | 212 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 178.062994177 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 178.062994177 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 35.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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