CC1=C(C(=CC=C1)C)Cl
CAS: 6781-98-2
Название: 2-chloro-1,3-dimethylbenzene
SMILES: CC1=C(C(=CC=C1)C)Cl

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: VDXLAYAQGYCQEO-UHFFFAOYSA-N
Синонимы
1-Chloro-2,6-dimethylbenzeneRefChem:861081-Cl-DMB2-Chloro-1,3-dimethylbenzene6781-98-22-Chloro-m-xylene2,6-Dimethylchlorobenzenem-Xylene, 2-chloro-Benzene, 2-chloro-1,3-dimethyl-2,6-Dimethylphenyl chlorideMFCD000005652-chloro-1,3-dimethyl-benzeneEINECS 229-843-42-chloro-meta-xyleneSCHEMBL144551SCHEMBL219312SCHEMBL3037020SCHEMBL3214002SCHEMBL92433502-chloro-1,3-dimethyl benzeneDTXSID40218061GAA781982-Chloro-1,3-dimethylbenzene, 97%AKOS000120055CS-W014356DS-11822SY048789DB-020946C2164NS00036190
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