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Abasic succiante

CAT: 0013-GTR19279804-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19279804-02Size:50 mg
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Description
Abasic Succinate is a monomeric raw material used in nucleic acid synthesis.
CAS Number
1428324-58-6
Smiles
C (OC[C@@H]1[C@@H] (OC (CCC (O) =O) =O) CCO1) (C2=CC=C (OC) C=C2) (C3=CC=C (OC) C=C3) C4=CC=CC=C4
Molecular Formula
C30H32O8
Molecular Weight
520.58
Notes
For research use only.

Chemical Information

4-[(2R,3S)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]oxolan-3-yl]oxy-4-oxobutanoic acid
CAS Number1428324-58-6
PubChem CID168447661
IUPAC Name4-[(2R,3S)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]oxolan-3-yl]oxy-4-oxobutanoic acid
Molecular FormulaC30H32O8
Molecular Weight520.6
XLogP4.1
Topological Polar Surface Area101
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count13
Heavy Atom Count38
Formal Charge0
Complexity711
SMILES
COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OC[C@@H]4[C@H](CCO4)OC(=O)CCC(=O)O
InChI
InChI=1S/C30H32O8/c1-34-24-12-8-22(9-13-24)30(21-6-4-3-5-7-21,23-10-14-25(35-2)15-11-23)37-20-27-26(18-19-36-27)38-29(33)17-16-28(31)32/h3-15,26-27H,16-20H2,1-2H3,(H,31,32)/t26-,27+/m0/s1
InChIKey
PURLJYSNZCUYOW-RRPNLBNLSA-N
Chemical Structure
2D Structure
2D structure of 4-[(2R,3S)-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]oxolan-3-yl]oxy-4-oxobutanoic acid
CAS: 1428324-58-6
CID: 168447661
Formula: C30H32O8
MW: 520.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight520.6
XLogP34.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count13
Exact Mass520.20971797
Monoisotopic Mass520.20971797
Topological Polar Surface Area101 Ų
Heavy Atom Count38
Formal Charge0
Complexity711
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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