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Chemical ID: 7154808
Chemical ID:
7154808
Name [?]:
[2-[(4-chlorophenyl)methoxy]phenyl]methanol
SMILES [?]:
c1ccc(c(c1)CO)OCc2ccc(cc2)Cl
InChi [?]:
InChI=1/C14H13ClO2/c15-13-7-5-11(6-8-13)10-17-14-4-2-1-3-12(14)9-16/h1-8,16H,9-10H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,12,16,13,15,7,10,11,5,14,4,17,8,9/E:(5,6)(7,8)/rA:17nCCCCCCCOOCCCCCCCCl/rB:s1;d2;s3;d4;d1s5;s5;s7;s4;s9;s10;s11;d12;s13;d14;d11s15;s14;/rC:;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H13ClO2 |
All Atoms: | 30 |
Heavy Atoms: | 17 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.30815 |
Area: | 443.482 |
Solvation: | -2.77891 |
Coulombic: | -27.7773 |
Bond Count [?]
All: | 18 |
Single: | 12 |
Double: | 6 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 248.705 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 2 |
XLogP: | 3.46 |
LogP (Chemaxon): | 3.55 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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