Chemical ID: 5757617

COCc1cc(ccc1OC)C=O
Chemical ID:
5757617
Name [?]:
4-methoxy-3-(methoxymethyl)benzaldehyde
SMILES [?]:
COCc1cc(ccc1OC)C=O
InChi [?]:
InChI=1/C10H12O3/c1-12-7-9-5-8(6-11)3-4-10(9)13-2/h3-6H,7H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,11,7,8,5,12,3,6,4,9,13,2,10/rA:13nCOCCCCCCCOCCO/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s10;s6;d12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H12O3
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:5.03882
Area:359.329
Solvation:-3.9444
Coulombic:-23.1036
Bond Count [?]
All:13
Single:9
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:180.2
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:1.34
LogP (Chemaxon):1.21

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