C(CCCCCC(=O)O)CCCCC(=O)O
CAS: 693-23-2
Name: dodecanedioic acid
SMILES: C(CCCCCC(=O)O)CCCCC(=O)O

Molecular Processing

Molecular formula
C12H22O4
Molecular weight
230.3
Exact mass
230.1518
XLogP
3.06
TPSA
74.6
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
11
Heavy atoms
16
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
61.44

Supplementary Information

InChIKey: TVIDDXQYHWJXFK-UHFFFAOYSA-N
Synonyme
DODECANEDIOIC ACID693-23-21,12-Dodecanedioic acid1,10-Decanedicarboxylic acidDecamethylenedicarboxylic acid1,10-DicarboxydecaneDTXSID3027297978YU42Q6INSC-400242CHEBI:4676DTXCID607297dodecandioic acidRefChem:7336211-746-3MFCD00002735n-Dodecanedioic acid1.10-DecanedicNSC400242Dodecanedioicacid53037-60-8CAS-693-23-2HSDB 5745EINECS 211-746-3NSC 400242UNII-978YU42Q6In-DodecanedioateDecane-1,10-dicarboxylic acidTwelve alkyl aciddodecane dioic acidCorfree M 2
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