Chemical ID: 7114492

CC1Cc2cc(ccc2O1)C=O
Chemical ID:
7114492
Name [?]:
2-methyl-2,3-dihydrobenzofuran-5-carbaldehyde
SMILES [?]:
CC1Cc2cc(ccc2O1)C=O
InChi [?]:
InChI=1/C10H10O2/c1-7-4-9-5-8(6-11)2-3-10(9)12-7/h2-3,5-7H,4H2,1H3
InChi Info:
AuxInfo=1/0/N:1,7,8,3,5,11,2,6,4,9,12,10/rA:12cCCCCCCCCCOCO/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s2s9;s6;d11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H10O2
All Atoms:22
Heavy Atoms:12
Chiral Atoms:1
ZAP Information [?]
Total:4.95908
Area:323.513
Solvation:-3.12874
Coulombic:-14.6092
Bond Count [?]
All:13
Single:9
Double:4
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:162.185
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:1.94
LogP (Chemaxon):1.86

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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