Ethyl 2-[bis(2-ethoxy-2-oxoethyl)amino]-4-diethoxyphosphorylbutanoate - CAS 1536463-75-8
Catalog: |
BB043087 |
Product Name: |
Ethyl 2-[bis(2-ethoxy-2-oxoethyl)amino]-4-diethoxyphosphorylbutanoate |
CAS: |
1536463-75-8 |
Synonyms: |
Triethyl 2-N,N-bis(ethoxycarbonylmethyl)amino-4-phosphonobutanoate |
IUPAC Name: | ethyl 2-[bis(2-ethoxy-2-oxoethyl)amino]-4-diethoxyphosphorylbutanoate |
Description: | Ethyl 2-[bis(2-ethoxy-2-oxoethyl)amino]-4-diethoxyphosphorylbutanoate (CAS# 1536463-75-8 ) is a useful research chemical. |
Molecular Weight: | 439.40 |
Molecular Formula: | C18H34NO9P |
Canonical SMILES: | CCOC(=O)CN(CC(=O)OCC)C(CCP(=O)(OCC)OCC)C(=O)OCC |
InChI: | InChI=1S/C18H34NO9P/c1-6-24-16(20)13-19(14-17(21)25-7-2)15(18(22)26-8-3)11-12-29(23,27-9-4)28-10-5/h15H,6-14H2,1-5H3 |
InChI Key: | ZNLGQRHNEMLGAR-UHFFFAOYSA-N |
Complexity: | 525 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 439.19711866 |
Formal Charge: | 0 |
Heavy Atom Count: | 29 |
Hydrogen Bond Acceptor Count: | 10 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 439.19711866 |
Rotatable Bond Count: | 19 |
Topological Polar Surface Area: | 118 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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