Chemical ID: 5788396

CC(C)(C)OC(=O)NC(CC1CCCCC1)CO
Chemical ID:
5788396
Name [?]:
tert-butyl [1-(cyclohexylmethyl)-2-hydroxy-ethyl]aminoformate
SMILES [?]:
CC(C)(C)OC(=O)NC(CC1CCCCC1)CO
InChi [?]:
InChI=1/C14H27NO3/c1-14(2,3)18-13(17)15-12(10-16)9-11-7-5-4-6-8-11/h11-12,16H,4-10H2,1-3H3,(H,15,17)
InChi Info:
AuxInfo=1/1/N:1,3,4,14,13,15,12,16,10,17,11,9,6,2,8,18,7,5/E:(1,2,3)(5,6)(7,8)/rA:18cCCCCOCONCCCCCCCCCO/rB:s1;s2;s2;s2;s5;d6;s6;s8;s9;s10;s11;s12;s13;s14;s11s15;s9;s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H27NO3
All Atoms:18
Heavy Atoms:18
Chiral Atoms:1
ZAP Information [?]
Total:9.34854
Area:466.47
Solvation:-2.31321
Coulombic:-51.8336
Bond Count [?]
All:18
Single:17
Double:1
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:257.369
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.73
LogP (Chemaxon):2.52

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