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89661-71-2 | tert-butyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate
CAS No: 89661-71-2 Catalog No: AG00IFSK MDL No:MFCD11040522
Product Description
Catalog Number:
AG00IFSK
Chemical Name:
tert-butyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate
CAS Number:
89661-71-2
Molecular Formula:
C12H20N2O3
Molecular Weight:
240.2988
MDL Number:
MFCD11040522
IUPAC Name:
tert-butyl N-(5-tert-butyl-1,2-oxazol-3-yl)carbamate
InChI:
InChI=1S/C12H20N2O3/c1-11(2,3)8-7-9(14-17-8)13-10(15)16-12(4,5)6/h7H,1-6H3,(H,13,14,15)
InChI Key:
VMPVVQOVODQCRS-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)N=c1[nH]oc(c1)C(C)(C)C
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.147g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
240.303g/mol
Monoisotopic Mass:
240.147g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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