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1588441-36-4 | Imidodicarbonic acid, 2-acetyl-, 1,3-bis(1,1-dimethylethyl) ester
CAS No: 1588441-36-4 Catalog No: AG001QY7 MDL No:MFCD26517078
Product Description
Catalog Number:
AG001QY7
Chemical Name:
Imidodicarbonic acid, 2-acetyl-, 1,3-bis(1,1-dimethylethyl) ester
CAS Number:
1588441-36-4
Molecular Formula:
C12H21NO5
Molecular Weight:
259.2988
MDL Number:
MFCD26517078
IUPAC Name:
tert-butyl N-acetyl-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate
InChI:
InChI=1S/C12H21NO5/c1-8(14)13(9(15)17-11(2,3)4)10(16)18-12(5,6)7/h1-7H3
InChI Key:
JRIWBSVVECUGGL-UHFFFAOYSA-N
SMILES:
CC(=O)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.142g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.302g/mol
Monoisotopic Mass:
259.142g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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