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1363382-20-0 | 1,1-Cyclobutanedicarboxylic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-, 1,1-bis(1-methylethyl) ester
CAS No: 1363382-20-0 Catalog No: AG0011Q5 MDL No:MFCD20922763
Product Description
Catalog Number:
AG0011Q5
Chemical Name:
1,1-Cyclobutanedicarboxylic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-, 1,1-bis(1-methylethyl) ester
CAS Number:
1363382-20-0
Molecular Formula:
C17H29NO6
Molecular Weight:
343.4153
MDL Number:
MFCD20922763
IUPAC Name:
dipropan-2-yl 3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclobutane-1,1-dicarboxylate
InChI:
InChI=1S/C17H29NO6/c1-10(2)22-13(19)17(14(20)23-11(3)4)8-12(9-17)18-15(21)24-16(5,6)7/h10-12H,8-9H2,1-7H3,(H,18,21)
InChI Key:
GKOKDSCWLNRKGQ-UHFFFAOYSA-N
SMILES:
CC(OC(=O)C1(CC(C1)NC(=O)OC(C)(C)C)C(=O)OC(C)C)C
Properties
Complexity:
462
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.199g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
343.42g/mol
Monoisotopic Mass:
343.199g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
90.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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