CC1=C(C=C(C=C1)Cl)C
CAS: 615-60-1
Name: 4-chloro-1,2-dimethylbenzene
SMILES: CC1=C(C=C(C=C1)Cl)C

Molecular Processing

Molecular formula
C8H9Cl
Molecular weight
140.61
Exact mass
140.0393
XLogP
2.96
TPSA
0
H-bond donors
0
H-bond acceptors
0
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
1
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
40.93

Supplementary Information

InChIKey: HNQLMBJUMVLFCF-UHFFFAOYSA-N
Synonyms
4-Chloro-o-xylene615-60-14-Chloro-1,2-dimethylbenzeneEINECS 210-438-6QO24WAW04QDTXSID50210470EC 210-438-6RefChem:5219124Chloro1,2dimethylbenzeneDTXCID50132961210-438-63,4-Dimethylchlorobenzene1-Chloro-3,4-dimethylbenzeneBenzene, 4-chloro-1,2-dimethyl-o-Xylene, 4-chloro-4-Chloro-ortho-xyleneMFCD000005964-CHLORO-1,2-XYLENEUNII-QO24WAW04Q4-chloro-1,2-dimethyl-benzene4-chloro ortho-xylene3,4-dimethyl-chlorobenzeneSCHEMBL91997SCHEMBL1003449SCHEMBL1007658SCHEMBL3214006SCHEMBL3702697SCHEMBL5322276SCHEMBL8949922SCHEMBL31556280
View source →
Involved in 30 reactions→

Extended Search

Substructure Search→Similarity Search→