Chemical ID: 5305661

COC(=O)c1ccc(cc1)O
Chemical ID:
5305661
Name [?]:
methyl 4-hydroxybenzoate
SMILES [?]:
COC(=O)c1ccc(cc1)O
InChi [?]:
InChI=1/C8H8O3/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5,9H,1H3
InChi Info:
AuxInfo=1/0/N:1,6,10,7,9,5,8,3,11,4,2/E:(2,3)(4,5)/rA:11nCOCOCCCCCCO/rB:s1;s2;d3;s3;s5;d6;s7;d8;d5s9;s8;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H8O3
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:5.48021
Area:313.53
Solvation:-2.35803
Coulombic:-36.1701
Bond Count [?]
All:11
Single:7
Double:4
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:152.147
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.55
LogP (Chemaxon):1.31

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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