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Home > Bromides > 1263280-03-0
1263280-03-0 | Pyrrolidine, 3-(3-bromophenyl)-1-ethyl-
CAS No: 1263280-03-0 Catalog No: AG000SL1 MDL No:
Product Description
Catalog Number:
AG000SL1
Chemical Name:
Pyrrolidine, 3-(3-bromophenyl)-1-ethyl-
CAS Number:
1263280-03-0
Molecular Formula:
C12H16BrN
Molecular Weight:
254.1661
IUPAC Name:
3-(3-bromophenyl)-1-ethylpyrrolidine
InChI:
InChI=1S/C12H16BrN/c1-2-14-7-6-11(9-14)10-4-3-5-12(13)8-10/h3-5,8,11H,2,6-7,9H2,1H3
InChI Key:
ZKLFJQPUTPGIOF-UHFFFAOYSA-N
SMILES:
CCN1CCC(C1)c1cccc(c1)Br
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.047g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.171g/mol
Monoisotopic Mass:
253.047g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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