Chemical ID: 6658943

CC(C)(C)c1ccc(c(c1)O)C(C)(C)C
Chemical ID:
6658943
Name [?]:
2,5-ditert-butylphenol
SMILES [?]:
CC(C)(C)c1ccc(c(c1)O)C(C)(C)C
InChi [?]:
InChI=1/C14H22O/c1-13(2,3)10-7-8-11(12(15)9-10)14(4,5)6/h7-9,15H,1-6H3
InChi Info:
AuxInfo=1/0/N:1,3,4,13,14,15,6,7,10,5,8,9,2,12,11/E:(1,2,3)(4,5,6)/rA:15nCCCCCCCCCCOCCCC/rB:s1;s2;s2;s2;s5;d6;s7;d8;d5s9;s9;s8;s12;s12;s12;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H22O
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:8.50897
Area:388.984
Solvation:-1.21562
Coulombic:-19.0583
Bond Count [?]
All:15
Single:12
Double:3
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:206.324
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:5.04
LogP (Chemaxon):5.02

Name Annotations

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Descriptor Annotations

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