CCOC1=C(C=C(C=C1)Cl)C(=O)Cl
CAS: 60531-34-2
이름: 5-chloro-2-ethoxybenzoyl chloride
SMILES: CCOC1=C(C=C(C=C1)Cl)C(=O)Cl

Molecular Processing

Molecular formula
C9H8Cl2O2
Molecular weight
219.07
Exact mass
217.9901
XLogP
3.12
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
52.8

Supplementary Information

InChIKey: BXINAIGLJUMHPW-UHFFFAOYSA-N
동의어
5-chloro-2-ethoxybenzoyl chloride60531-34-2MFCD11939741Benzoyl chloride, 5-chloro-2-ethoxy-3-Chloro-6-ethoxybenzoyl chlorideSCHEMBL33851532-ethoxy-5-chloro-benzoylchlorideBXINAIGLJUMHPW-UHFFFAOYSA-N2-ethoxy-5-chloro-benzoyl chloride5-chloro-2-ethoxy-benzoyl chlorideALBB-011497BBL036951STL507849AKOS005148408VS-13790DB-196469H26495F368960
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