이름: 6-methoxy-6-oxohexanoate
SMILES:
COC(=O)CCCCC(=O)[O-]Molecular Processing
Molecular formula
C7H11O4-
Molecular weight
159.16
Exact mass
159.0663
XLogP
-0.53
TPSA
66.43
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
11
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
-1
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
35.49
Supplementary Information
InChIKey: UOBSVARXACCLLH-UHFFFAOYSA-M
동의어
Methyl adipateMonomethyladipate6-methoxy-6-oxohexanoateUOBSVARXACCLLH-UHFFFAOYSA-MAKOS015839633
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