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87988-50-9 | Diaziridine, 1-methyl-3-phenyl-
CAS No: 87988-50-9 Catalog No: AG004HRN MDL No:
Product Description
Catalog Number:
AG004HRN
Chemical Name:
Diaziridine, 1-methyl-3-phenyl-
CAS Number:
87988-50-9
Molecular Formula:
C8H10N2
Molecular Weight:
134.1784
IUPAC Name:
1-methyl-3-phenyldiaziridine
InChI:
InChI=1S/C8H10N2/c1-10-8(9-10)7-5-3-2-4-6-7/h2-6,8-9H,1H3
InChI Key:
NQQHMHNCHQEMKL-UHFFFAOYSA-N
SMILES:
CN1NC1c1ccccc1
Properties
Complexity:
118
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.084g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
134.182g/mol
Monoisotopic Mass:
134.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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