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68835-89-2 | Di-tert-amyl Dicarbonate , 95%
CAS No: 68835-89-2 Catalog No: AG003PRM MDL No:MFCD00038320
Product Description
Catalog Number:
AG003PRM
Chemical Name:
Di-tert-amyl Dicarbonate , 95%
CAS Number:
68835-89-2
Molecular Formula:
C12H22O5
Molecular Weight:
246.3001
MDL Number:
MFCD00038320
IUPAC Name:
2-methylbutan-2-yl 2-methylbutan-2-yloxycarbonyl carbonate
InChI:
InChI=1S/C12H22O5/c1-7-11(3,4)16-9(13)15-10(14)17-12(5,6)8-2/h7-8H2,1-6H3
InChI Key:
PGWKKYVDHYLHNF-UHFFFAOYSA-N
SMILES:
CCC(OC(=O)OC(=O)OC(CC)(C)C)(C)C
EC Number:
272-436-1
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.147g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.303g/mol
Monoisotopic Mass:
246.147g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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