Chemical ID: 5154051

CC(C)(C=O)c1ccccc1
Chemical ID:
5154051
Name [?]:
2-methyl-2-phenyl-propanal
SMILES [?]:
CC(C)(C=O)c1ccccc1
InChi [?]:
InChI=1/C10H12O/c1-10(2,8-11)9-6-4-3-5-7-9/h3-8H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,9,8,10,7,11,4,6,2,5/E:(1,2)(4,5)(6,7)/rA:11nCCCCOCCCCCC/rB:s1;s2;s2;d4;s2;s6;d7;s8;d9;d6s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H12O
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:5.87152
Area:313.718
Solvation:-1.97144
Coulombic:-8.91871
Bond Count [?]
All:11
Single:7
Double:4
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:148.202
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:2.79
LogP (Chemaxon):2.49

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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