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180181-02-6 | Propanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-2,2-dimethyl-
CAS No: 180181-02-6 Catalog No: AG0021RY MDL No:MFCD09952625
Product Description
Catalog Number:
AG0021RY
Chemical Name:
Propanoic acid, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-2,2-dimethyl-
CAS Number:
180181-02-6
Molecular Formula:
C10H19NO4
Molecular Weight:
217.2622
MDL Number:
MFCD09952625
IUPAC Name:
2,2-dimethyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI:
InChI=1S/C10H19NO4/c1-9(2,3)15-8(14)11-6-10(4,5)7(12)13/h6H2,1-5H3,(H,11,14)(H,12,13)
InChI Key:
LSZXQEWVQORQBO-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCC(C(=O)O)(C)C
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.131g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
217.265g/mol
Monoisotopic Mass:
217.131g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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