Chemical ID: 6659302

CCCCOC(=O)CC1CCCN1C
Chemical ID:
6659302
Name [?]:
butyl 2-(1-methylpyrrolidin-2-yl)acetate
SMILES [?]:
CCCCOC(=O)CC1CCCN1C
InChi [?]:
InChI=1/C11H21NO2/c1-3-4-8-14-11(13)9-10-6-5-7-12(10)2/h10H,3-9H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,14,2,3,11,10,12,4,8,9,6,13,7,5/rA:14cCCCCOCOCCCCCNC/rB:s1;s2;s3;s4;s5;d6;s6;s8;s9;s10;s11;s9s12;s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H21NO2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:2
ZAP Information [?]
Total:8.17775
Area:403.062
Solvation:-1.8988
Coulombic:-23.5001
Bond Count [?]
All:14
Single:13
Double:1
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:199.29
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:1.82
LogP (Chemaxon):1.52

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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