Name: Name:Methyl (4R,5S)-2,2,5-trimethyl-1,3-dioxolane-4-carboxylate
Brand: Angene
SKU: AG00G263
Rating: 90 (10 reviews)

Methyl (4R,5S)-2,2,5-trimethyl-1,3-dioxolane-4-carboxylate

CAS No.:

78086-72-3

Catalog Number:

AG00G263

Molecular Formula:

C8H14O4

Molecular Weight:

174.1944

Catalog Number:

AG00G263

Chemical Name:

Methyl (4R,5S)-2,2,5-trimethyl-1,3-dioxolane-4-carboxylate

CAS Number:

78086-72-3

Molecular Formula:

C8H14O4

Molecular Weight:

174.1944

MDL Number:

MFCD00077802

IUPAC Name:

methyl (4R,5S)-2,2,5-trimethyl-1,3-dioxolane-4-carboxylate

InChI:

InChI=1S/C8H14O4/c1-5-6(7(9)10-4)12-8(2,3)11-5/h5-6H,1-4H3/t5-,6+/m0/s1

InChI Key:

AELKYRWKHKGMAD-NTSWFWBYSA-N

SMILES:

COC(=O)[C@@H]1OC(O[C@H]1C)(C)C

Complexity:

188

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

174.089g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

174.196g/mol

Monoisotopic Mass:

174.089g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

44.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8