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Home > Other Heterocycles > 22501-53-7
22501-53-7 | N-{bicyclo[2.2.1]hept-5-en-2-ylmethyl}aniline
CAS No: 22501-53-7 Catalog No: AG01AZC8 MDL No:MFCD13789317
Product Description
Catalog Number:
AG01AZC8
Chemical Name:
N-{bicyclo[2.2.1]hept-5-en-2-ylmethyl}aniline
CAS Number:
22501-53-7
Molecular Formula:
C14H17N
Molecular Weight:
199.2915
MDL Number:
MFCD13789317
IUPAC Name:
N-(2-bicyclo[2.2.1]hept-5-enylmethyl)aniline
InChI:
InChI=1S/C14H17N/c1-2-4-14(5-3-1)15-10-13-9-11-6-7-12(13)8-11/h1-7,11-13,15H,8-10H2
InChI Key:
GTZPXNKIRYPRGU-UHFFFAOYSA-N
SMILES:
C(C1CC2CC1C=C2)Nc1ccccc1
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.136g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.297g/mol
Monoisotopic Mass:
199.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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