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Chemical ID: 4929713

c1ccc(cc1)C2(CCCCCCCCC(CCCCCCCC2)(c3ccccc3)O)O

Chemical ID:

4929713

Name [?]:

1,10-diphenylcyclooctadecane-1,10-diol

SMILES [?]:

c1ccc(cc1)C2(CCCCCCCCC(CCCCCCCC2)(c3ccccc3)O)O

InChi [?]:

InChI=1/C30H44O2/c31-29(27-19-11-9-12-20-27)23-15-5-1-2-6-16-24-30(32,28-21-13-10-14-22-28)26-18-8-4-3-7-17-25-29/h9-14,19-22,31-32H,1-8,15-18,23-26H2

InChi Info:

AuxInfo=1/0/N:11,12,21,20,10,13,22,19,1,28,2,6,27,29,9,14,23,18,3,5,26,30,8,15,24,17,4,25,7,16,32,31/E:(1,2,3,4)(5,6,7,8)(9,10)(11,12,13,14)(15,16,17,18)(19,20,21,22)(23,24,25,26)(27,28)(29,30)(31,32)/rA:32nCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCOO/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;s10;s11;s12;s13;s14;s15;s16;s17;s18;s19;s20;s21;s22;s7s23;s16;s25;d26;s27;d28;d25s29;s16;s7;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₃₀H₄₄O₂
All Atoms:	32
Heavy Atoms:	32
Chiral Atoms:	0

ZAP Information [?]

Total:	11.7213
Area:	581.583
Solvation:	-2.81826
Coulombic:	-41.5939

Bond Count [?]

All:	34
Single:	28
Double:	6
Rotors:	2
Chiral:	0
Rigid Segments:	3

Chemical Properties

Molecular Weight:	436.669
H-Bond Donors:	2
H-Bond Acceptors:	2
XLogP:	9.0
LogP (Chemaxon):	8.04

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value