Chemical ID: 6468162

c1ccc(cc1)C2CCc3ccccc3O2
Chemical ID:
6468162
Name [?]:
2-phenylchroman
SMILES [?]:
c1ccc(cc1)C2CCc3ccccc3O2
InChi [?]:
InChI=1/C15H14O/c1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)16-15/h1-9,15H,10-11H2
InChi Info:
AuxInfo=1/0/N:1,2,6,12,13,3,5,11,14,9,8,4,10,15,7,16/E:(2,3)(6,7)/rA:16cCCCCCCCCCCCCCCCO/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;s10;d11;s12;d13;d10s14;s7s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14O
All Atoms:16
Heavy Atoms:16
Chiral Atoms:1
ZAP Information [?]
Total:7.90232
Area:386.455
Solvation:-1.75906
Coulombic:-11.2464
Bond Count [?]
All:18
Single:12
Double:6
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:210.271
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.95
LogP (Chemaxon):4.02

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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