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Home > Other Heterocycles > 1558869-72-9
1558869-72-9 | tert-butyl N-{7-oxabicyclo[2.2.1]heptan-2-yl}carbamate
CAS No: 1558869-72-9 Catalog No: AG01ACYO MDL No:MFCD23944775
Product Description
Catalog Number:
AG01ACYO
Chemical Name:
tert-butyl N-{7-oxabicyclo[2.2.1]heptan-2-yl}carbamate
CAS Number:
1558869-72-9
Molecular Formula:
C11H19NO3
Molecular Weight:
213.2735
MDL Number:
MFCD23944775
IUPAC Name:
tert-butyl N-(7-oxabicyclo[2.2.1]heptan-2-yl)carbamate
InChI:
InChI=1S/C11H19NO3/c1-11(2,3)15-10(13)12-8-6-7-4-5-9(8)14-7/h7-9H,4-6H2,1-3H3,(H,12,13)
InChI Key:
WLVHAJCRVANNGK-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CC2OC1CC2
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.136g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.277g/mol
Monoisotopic Mass:
213.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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