Ethyl 4-Bromo-2,2-Dimethyl-3-Oxobutanoate - CAS 63891-88-3
Catalog: |
BB065438 |
Product Name: |
Ethyl 4-Bromo-2,2-Dimethyl-3-Oxobutanoate |
CAS: |
63891-88-3 |
Synonyms: |
ethyl 4-bromo-2,2-dimethyl-3-oxobutanoate;ethyl4-bromo-2,2-dimethyl-3-oxobutanoate |
IUPAC Name: | ethyl 4-bromo-2,2-dimethyl-3-oxobutanoate |
Molecular Weight: | 237.09 |
Molecular Formula: | C8H13O3Br |
Canonical SMILES: | CCOC(=O)C(C)(C)C(=O)CBr |
InChI: | InChI=1S/C8H13BrO3/c1-4-12-7(11)8(2,3)6(10)5-9/h4-5H2,1-3H3 |
InChI Key: | XHIXCENTXGJBFA-UHFFFAOYSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Danger |
Complexity: | 187 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 236.00481 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 236.00481 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 43.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Other Building Blocks
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS