CC1(CCC(O1)CBr)C(C)(C)COC2=CC=C(C=C2)Cl
이름: 5-(bromomethyl)-2-[1-(4-chlorophenoxy)-2-methylpropan-2-yl]-2-methyloxolane
SMILES: CC1(CCC(O1)CBr)C(C)(C)COC2=CC=C(C=C2)Cl

Molecular Processing

Molecular formula
C16H22BrClO2
Molecular weight
361.71
Exact mass
360.0492
XLogP
5.08
TPSA
18.46
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
87.03

Supplementary Information

InChIKey: LYKXSHFOMDVSNU-UHFFFAOYSA-N
동의어
SCHEMBL10536073LYKXSHFOMDVSNU-UHFFFAOYSA-N2-bromomethyl-5-[1-(4-chlorophenoxy)-2-methyl-prop-2-yl]-5-methyl-tetrahydrofuran2-bromomethyl-5-[1-(4-chlorophenoxy)-2-methylprop-2-yl]-5-methyl-tetrahydrofuran
출처 보기 →
8개 반응에 참여→

확장 검색

부분 구조 검색→유사 구조 검색→