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916891-97-9 | tert-Butyl imidazolidine-1-carboxylate
CAS No: 916891-97-9 Catalog No: AG003A8A MDL No:MFCD22199572
Product Description
Catalog Number:
AG003A8A
Chemical Name:
tert-Butyl imidazolidine-1-carboxylate
CAS Number:
916891-97-9
Molecular Formula:
C8H16N2O2
Molecular Weight:
172.2248
MDL Number:
MFCD22199572
IUPAC Name:
tert-butyl imidazolidine-1-carboxylate
InChI:
InChI=1S/C8H16N2O2/c1-8(2,3)12-7(11)10-5-4-9-6-10/h9H,4-6H2,1-3H3
InChI Key:
UROHOOQSDVUQGF-UHFFFAOYSA-N
SMILES:
O=C(N1CNCC1)OC(C)(C)C
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.121g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
172.228g/mol
Monoisotopic Mass:
172.121g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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