Chemical ID: 4088398

C1CC(C1)(C(=O)O)C(=O)O
Chemical ID:
4088398
Name [?]:
cyclobutane-1,1-dicarboxylic acid
SMILES [?]:
C1CC(C1)(C(=O)O)C(=O)O
InChi [?]:
InChI=1/C6H8O4/c7-4(8)6(5(9)10)2-1-3-6/h1-3H2,(H,7,8)(H,9,10)
InChi Info:
AuxInfo=1/1/N:1,2,4,5,8,3,6,7,9,10/E:(2,3)(4,5)(7,8,9,10)/gE:(1,2)/rA:10nCCCCCOOCOO/rB:s1;s2;s1s3;s3;d5;s5;s3;d8;s8;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H8O4
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:4.80486
Area:283.827
Solvation:-2.29082
Coulombic:-52.334
Bond Count [?]
All:10
Single:8
Double:2
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:144.125
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:0.85
LogP (Chemaxon):0.81

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Descriptor Annotations

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