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957065-89-3 | 1-(2,3-Dimethylphenyl)pyrrolidine
CAS No: 957065-89-3 Catalog No: AG003CSP MDL No:MFCD09878389
Product Description
Catalog Number:
AG003CSP
Chemical Name:
1-(2,3-Dimethylphenyl)pyrrolidine
CAS Number:
957065-89-3
Molecular Formula:
C12H17N
Molecular Weight:
175.2701
MDL Number:
MFCD09878389
IUPAC Name:
1-(2,3-dimethylphenyl)pyrrolidine
InChI:
InChI=1S/C12H17N/c1-10-6-5-7-12(11(10)2)13-8-3-4-9-13/h5-7H,3-4,8-9H2,1-2H3
InChI Key:
OPHSFWFVNOENHP-UHFFFAOYSA-N
SMILES:
Cc1c(C)cccc1N1CCCC1
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.136g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.275g/mol
Monoisotopic Mass:
175.136g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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