Chemical ID: 4115510

CCCCCCCCCCCCOP(=O)(O)O
Chemical ID:
4115510
Name [?]:
dodecoxyphosphonic acid
SMILES [?]:
CCCCCCCCCCCCOP(=O)(O)O
InChi [?]:
InChI=1/C12H27O4P/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15/h2-12H2,1H3,(H2,13,14,15)
InChi Info:
AuxInfo=1/1/N:1,2,3,4,5,6,7,8,9,10,11,12,15,16,17,13,14/E:(13,14,15)/rA:17nCCCCCCCCCCCCOPOOO/rB:s1;s2;s3;s4;s5;s6;s7;s8;s9;s10;s11;s12;s13;d14;s14;s14;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H27O4P
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:10.5974
Area:525.607
Solvation:-2.54279
Coulombic:-55.3716
Bond Count [?]
All:16
Single:15
Double:1
Rotors:12
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:266.314
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:4.17
LogP (Chemaxon):3.33

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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