4-(tert-butoxy)-2,2-dimethylbutanal - CAS 1995439-32-1
Catalog: |
BB076723 |
Product Name: |
4-(tert-butoxy)-2,2-dimethylbutanal |
CAS: |
1995439-32-1 |
Synonyms: |
4-(tert-butoxy)-2,2-dimethylbutanal; 2,2-dimethyl-4-[(2-methylpropan-2-yl)oxy]butanal |
IUPAC Name: | 2,2-dimethyl-4-[(2-methylpropan-2-yl)oxy]butanal |
Description: | 4-(tert-butoxy)-2,2-dimethylbutanal (cas# 1995439-32-1) is a useful research chemical. |
Molecular Weight: | 172.26 |
Molecular Formula: | C10H20O2 |
Canonical SMILES: | CC(C)(C)OCCC(C)(C)C=O |
InChI: | InChI=1S/C10H20O2/c1-9(2,3)12-7-6-10(4,5)8-11/h8H,6-7H2,1-5H3 |
InChI Key: | NMCUPAFDTZQNOT-UHFFFAOYSA-N |
Complexity: | 142 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 172.146329876 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 172.146329876 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 26.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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