C1=CC(=C(C=C1O)Cl)Cl
CAS: 95-77-2
Name: 3,4-dichlorophenol
SMILES: C1=CC(=C(C=C1O)Cl)Cl

Molecular Processing

Molecular formula
C6H4Cl2O
Molecular weight
163
Exact mass
161.9639
XLogP
2.7
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
9
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
38.13

Supplementary Information

InChIKey: WDNBURPWRNALGP-UHFFFAOYSA-N
Synonyms
3,4-DICHLOROPHENOL95-77-2Phenol, 3,4-dichloro-4,5-DichlorophenolDTXSID7025005070FTM6DVFNSC-60648DTXCID505005RefChem:91036202-450-5MFCD00002258CCRIS 5904HSDB 4247EINECS 202-450-5NSC 60648UNII-070FTM6DVFBRN 19076933,4dichlorophenol3,4 dichlorophenol3, 4-dichlorophenol3,4-dichloro phenol3,4-Dichloro-phenol3,4-Dichlorophenol, 99%4-06-00-00952 (Beilstein Handbook Reference)MLS002454371BIDD:ER0233SCHEMBL224868SCHEMBL330756DICHLOROPHENOL, 3,4-SCHEMBL6055748
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