Chemical ID: 6691052

CC1(CCCN1C(=O)OC(C)(C)C)C(=O)O
Chemical ID:
6691052
Name [?]:
2-methyl-1-tert-butoxycarbonyl-pyrrolidine-2-carboxylic acid
SMILES [?]:
CC1(CCCN1C(=O)OC(C)(C)C)C(=O)O
InChi [?]:
InChI=1/C11H19NO4/c1-10(2,3)16-9(15)12-7-5-6-11(12,4)8(13)14/h5-7H2,1-4H3,(H,13,14)
InChi Info:
AuxInfo=1/1/N:11,12,13,1,4,3,5,14,7,10,2,6,15,16,8,9/E:(1,2,3)(13,14)/rA:16cCCCCCNCOOCCCCCOO/rB:s1;s2;s3;s4;s2s5;s6;d7;s7;s9;s10;s10;s10;s2;d14;s14;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H19NO4
All Atoms:16
Heavy Atoms:16
Chiral Atoms:1
ZAP Information [?]
Total:7.42709
Area:390.612
Solvation:-2.3382
Coulombic:-56.4868
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:1.42
LogP (Chemaxon):1.18

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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