Chemical ID: 4967817

CC(C)OC(=O)C1(CCCC1)N
Chemical ID:
4967817
Name [?]:
isopropyl 1-aminocyclopentane-1-carboxylate
SMILES [?]:
CC(C)OC(=O)C1(CCCC1)N
InChi [?]:
InChI=1/C9H17NO2/c1-7(2)12-8(11)9(10)5-3-4-6-9/h7H,3-6,10H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,9,10,8,11,2,5,7,12,6,4/E:(1,2)(3,4)(5,6)/rA:12nCCCOCOCCCCCN/rB:s1;s2;s2;s4;d5;s5;s7;s8;s9;s7s10;s7;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H17NO2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:7.16611
Area:345.947
Solvation:-1.48255
Coulombic:-32.5648
Bond Count [?]
All:12
Single:11
Double:1
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:171.237
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:1.03
LogP (Chemaxon):0.89

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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