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13906-90-6 | Aziridine, 2-(phenylmethyl)-
CAS No: 13906-90-6 Catalog No: AG001A4H MDL No:
Product Description
Catalog Number:
AG001A4H
Chemical Name:
Aziridine, 2-(phenylmethyl)-
CAS Number:
13906-90-6
Molecular Formula:
C9H11N
Molecular Weight:
133.1903
IUPAC Name:
2-benzylaziridine
InChI:
InChI=1S/C9H11N/c1-2-4-8(5-3-1)6-9-7-10-9/h1-5,9-10H,6-7H2
InChI Key:
LKQAJXTWYDNYHK-UHFFFAOYSA-N
SMILES:
N1CC1Cc1ccccc1
EC Number:
237-677-9
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.089g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
133.194g/mol
Monoisotopic Mass:
133.089g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
21.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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