CAS: 666726-33-6
名称: 4-(bromomethyl)-6-(2-methoxyphenyl)-2,2-dimethyl-1H-quinoline
SMILES:
CC1(C=C(C2=C(N1)C=CC(=C2)C3=CC=CC=C3OC)CBr)CMolecular Processing
Molecular formula
C19H20BrNO
Molecular weight
358.28
Exact mass
357.0728
XLogP
5.34
TPSA
21.26
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
97.9
Supplementary Information
InChIKey: YBBJDCWTMOYSQJ-UHFFFAOYSA-N
同義語
4-(bromomethyl)-6-(2-methoxyphenyl)-2,2-dimethyl-1,2-dihydroquinoline4-(bromomethyl)-6-(2-methoxyphenyl)-2,2-dimethyl-1H-quinolineC19H20BrNO666726-33-6SCHEMBL4704358YBBJDCWTMOYSQJ-UHFFFAOYSA-N4-bromomethyl-6-(2-methoxyphenyl)-2,2-dimethyl-1,2-dihydroquinoline
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