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Chemical ID: 5009370
Chemical ID:
5009370
Name [?]:
2-(p-tolyl)pyrrolidine
SMILES [?]:
Cc1ccc(cc1)C2CCCN2
InChi [?]:
InChI=1/C11H15N/c1-9-4-6-10(7-5-9)11-3-2-8-12-11/h4-7,11-12H,2-3,8H2,1H3
InChi Info:
AuxInfo=1/0/N:1,10,9,3,7,4,6,11,2,5,8,12/E:(4,5)(6,7)/rA:12cCCCCCCCCCCCN/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s10;s8s11;/rC:;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H15N |
All Atoms: | 12 |
Heavy Atoms: | 12 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 7.37452 |
Area: | 332.75 |
Solvation: | -0.944233 |
Coulombic: | -10.3657 |
Bond Count [?]
All: | 13 |
Single: | 10 |
Double: | 3 |
Rotors: | 1 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 161.244 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 1 |
XLogP: | 2.58 |
LogP (Chemaxon): | 2.44 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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