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Home > Other Heterocycles > 1981-34-6
1981-34-6 | 2-Azabicyclo[3.2.0]hept-6-en-3-one, 1,4,6-trimethyl-
CAS No: 1981-34-6 Catalog No: AG002BAI MDL No:MFCD24554572
Product Description
Catalog Number:
AG002BAI
Chemical Name:
2-Azabicyclo[3.2.0]hept-6-en-3-one, 1,4,6-trimethyl-
CAS Number:
1981-34-6
Molecular Formula:
C9H13NO
Molecular Weight:
151.2056
MDL Number:
MFCD24554572
IUPAC Name:
1,4,6-trimethyl-2-azabicyclo[3.2.0]hept-6-en-3-one
InChI:
InChI=1S/C9H13NO/c1-5-4-9(3)7(5)6(2)8(11)10-9/h4,6-7H,1-3H3,(H,10,11)
InChI Key:
FNKHIIYOZBUSLD-UHFFFAOYSA-N
SMILES:
O=C1NC2(C(C1C)C(=C2)C)C
NSC Number:
135351
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.1g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
151.209g/mol
Monoisotopic Mass:
151.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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