Di-tert-butyl L-(+)-tartrate

• CAS: 117384-45-9
• Catalog Number: ACM117384459
• Category: Other Products
• Molecular Weight: 262.3
• Molecular Formula: C₁₂H₂₂O₆
• Synonyms: (+)-Di-tert-butyl L-tartrate, Di-tert-butyl L-(+)-Tartrate, 117384-45-9, 420026_ALDRICH, 95357_FLUKA, 95359_FLUKA, CTK4B0241, ANW-17020, AKOS016016037, AG-D-39254, L-(+)-Tartaric Acid Di-tert-Butyl Ester, D3898, FT-0628019, I14-45641, Butanedioic acid,2,3-dihydroxy- (2R,3R)-, 1,4-bis(1,1-dimethylethyl) ester, Butanedioicacid, 2,3-dihydroxy- (2R,3R)-, bis(1,1-dimethylethyl) ester (9CI); Butanedioicacid, 2,3-dihydroxy-[R-(R*,R*)]-, bis(1,1-dimethylethyl) ester;(2R,3R)-Di-tert-butyl tartrate; Di-tert-butyl (+)-L-tartrate; Di-tert-butyltartrate; L-(+)-Tartaric acid di-tert-butyl ester
• IUPAC Name: ditert-butyl (2R,3R)-2,3-dihydroxybutanedioate
• Canonical SMILES: CC(C)(C)OC(=O)C(C(C(=O)OC(C)(C)C)O)O
• InChI: InChI=1S/C12H22O6/c1-11(2,3)17-9(15)7(13)8(14)10(16)18-12(4,5)6/h7-8,13-14H,1-6H3/t7-,8-/m1/s1
• InChI Key: ITWOKJQQGHCDBL-HTQZYQBOSA-N
• Boiling Point: 321.8ºC at 760mmHg
• Melting Point: 90-92ºC(lit.)
• Flash Point: 109.2ºC
• Density: 1.143g/cm³
• Complexity: 278
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 2
• Exact Mass: 262.14200
• H-Bond Acceptor: 6
• H-Bond Donor: 2
• Heavy Atom Count: 18
• Monoisotopic Mass: 262.142g/mol
• Rotatable Bond Count: 7
• Safety Description: S22-S24/25
• Topological Polar Surface Area: 93.1A^2

Custom Q&A

What is the molecular formula of Di-tert-butyl L-(+)-Tartrate?

The molecular formula of Di-tert-butyl L-(+)-Tartrate is C12H22O6.

What is the molecular weight of Di-tert-butyl L-(+)-Tartrate?

The molecular weight of Di-tert-butyl L-(+)-Tartrate is 262.30 g/mol.

What is the IUPAC Name of Di-tert-butyl L-(+)-Tartrate?

The IUPAC Name of Di-tert-butyl L-(+)-Tartrate is ditert-butyl (2R,3R)-2,3-dihydroxybutanedioate.

What is the InChI of Di-tert-butyl L-(+)-Tartrate?

The InChI of Di-tert-butyl L-(+)-Tartrate is InChI=1S/C12H22O6/c1-11(2,3)17-9(15)7(13)8(14)10(16)18-12(4,5)6/h7-8,13-14H,1-6H3/t7-,8-/m1/s1.

What is the InChIKey of Di-tert-butyl L-(+)-Tartrate?

The InChIKey of Di-tert-butyl L-(+)-Tartrate is ITWOKJQQGHCDBL-HTQZYQBOSA-N.

What is the Canonical SMILES of Di-tert-butyl L-(+)-Tartrate?

The Canonical SMILES of Di-tert-butyl L-(+)-Tartrate is CC(C)(C)OC(=O)C(C(C(=O)OC(C)(C)C)O)O.

What is the Isomeric SMILES of Di-tert-butyl L-(+)-Tartrate?

The Isomeric SMILES of Di-tert-butyl L-(+)-Tartrate is CC(C)(C)OC(=O)[C@@H]([C@H](C(=O)OC(C)(C)C)O)O.

What is the CAS number of Di-tert-butyl L-(+)-Tartrate?

The CAS number of Di-tert-butyl L-(+)-Tartrate is 117384-45-9.

What is the XLogP3 value of Di-tert-butyl L-(+)-Tartrate?

The XLogP3 value of Di-tert-butyl L-(+)-Tartrate is 0.9.

Is Di-tert-butyl L-(+)-Tartrate a canonical compound?

Yes, Di-tert-butyl L-(+)-Tartrate is a canonical compound.