COCOCC1=C(C2=CC=CC=C2C=C1)Br
CAS: 905710-74-9
이름: 1-bromo-2-(methoxymethoxymethyl)naphthalene
SMILES: COCOCC1=C(C2=CC=CC=C2C=C1)Br

Molecular Processing

Molecular formula
C13H13BrO2
Molecular weight
281.15
Exact mass
280.0099
XLogP
3.72
TPSA
18.46
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
68.31

Supplementary Information

InChIKey: YIHFZZAUSZFESU-UHFFFAOYSA-N
동의어
1-bromo-2-(methoxymethoxymethyl)naphthalene905710-74-9SCHEMBL500350YIHFZZAUSZFESU-UHFFFAOYSA-NDA-40682
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