Chemical ID: 3963750

CC(C)(C)OC(=O)N1CCCCC1C(=O)O
Chemical ID:
3963750
Name [?]:
1-tert-butoxycarbonylpiperidine-2-carboxylic acid
SMILES [?]:
CC(C)(C)OC(=O)N1CCCCC1C(=O)O
InChi [?]:
InChI=1/C11H19NO4/c1-11(2,3)16-10(15)12-7-5-4-6-8(12)9(13)14/h8H,4-7H2,1-3H3,(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,3,4,11,10,12,9,13,14,6,2,8,15,16,7,5/E:(1,2,3)(13,14)/rA:16cCCCCOCONCCCCCCOO/rB:s1;s2;s2;s2;s5;d6;s6;s8;s9;s10;s11;s8s12;s13;d14;s14;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H19NO4
All Atoms:16
Heavy Atoms:16
Chiral Atoms:1
ZAP Information [?]
Total:7.24928
Area:391.922
Solvation:-2.54877
Coulombic:-56.0578
Bond Count [?]
All:16
Single:14
Double:2
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:229.273
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:1.67
LogP (Chemaxon):1.38

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Descriptor Annotations

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