Chemical ID: 7228791

c1c2c(cc(c1O)O)CC(CC2)[NH3+]
Chemical ID:
7228791
Name [?]:
(6,7-dihydroxytetralin-2-yl)ammonium
SMILES [?]:
c1c2c(cc(c1O)O)CC(CC2)[NH3+]
InChi [?]:
InChI=1/C10H13NO2/c11-8-2-1-6-4-9(12)10(13)5-7(6)3-8/h4-5,8,12-13H,1-3,11H2/p+1
InChi Info:
AuxInfo=1/1/N:12,11,9,1,4,2,3,10,6,5,13,7,8/rA:13cCCCCCCOOCCCCN+/rB:s1;d2;s3;d4;d1s5;s6;s5;s3;s9;s10;s2s11;s10;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H14NO2+
All Atoms:27
Heavy Atoms:13
Chiral Atoms:1
ZAP Information [?]
Total:-34.2835
Area:336.071
Solvation:-42.6853
Coulombic:12.1675
Bond Count [?]
All:14
Single:11
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:180.224
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:1.16
LogP (Chemaxon):-0.18

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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