Chemical ID: 5027133

CCCCCOC(=O)NCCO
Chemical ID:
5027133
Name [?]:
pentyl 2-hydroxyethylaminoformate
SMILES [?]:
CCCCCOC(=O)NCCO
InChi [?]:
InChI=1/C8H17NO3/c1-2-3-4-7-12-8(11)9-5-6-10/h10H,2-7H2,1H3,(H,9,11)
InChi Info:
AuxInfo=1/1/N:1,2,3,4,10,11,5,7,9,12,8,6/rA:12nCCCCCOCONCCO/rB:s1;s2;s3;s4;s5;s6;d7;s7;s9;s10;s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H17NO3
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:7.00326
Area:387.141
Solvation:-2.67526
Coulombic:-50.5423
Bond Count [?]
All:11
Single:10
Double:1
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:175.226
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:1.09
LogP (Chemaxon):1.0

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Descriptor Annotations

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