이름: 3,5-dichloro-4-dodecoxybenzoic acid
SMILES:
CCCCCCCCCCCCOC1=C(C=C(C=C1Cl)C(=O)O)ClMolecular Processing
Molecular formula
C19H28Cl2O3
Molecular weight
375.34
Exact mass
374.1416
XLogP
6.99
TPSA
46.53
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
13
Heavy atoms
24
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.632
Molar refractivity
100.76
Supplementary Information
InChIKey: KFWLPUZASBTNPW-UHFFFAOYSA-N
동의어
SCHEMBL6557422KFWLPUZASBTNPW-UHFFFAOYSA-N3,5-Dichloro-4-dodecyloxybenzoic acid
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