CAS: 93-91-4
الاسم: 1-phenylbutane-1,3-dione
SMILES:
CC(=O)CC(=O)C1=CC=CC=C1Molecular Processing
Molecular formula
C10H10O2
Molecular weight
162.19
Exact mass
162.0681
XLogP
1.85
TPSA
34.14
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
46.07
Supplementary Information
InChIKey: CVBUKMMMRLOKQR-UHFFFAOYSA-N
مرادفات
Benzoylacetone93-91-41,3-Butanedione, 1-phenyl-Acetoacetophenone1-Benzoyl-2-propanoneAcetylbenzoylmethane2-Propanone, benzoyl-2-Acetylacetophenonealpha-AcetylacetophenoneI3RUV8U115RefChem:1187881-Phenylbutane-1,3-dione1-PHENYL-1,3-BUTANEDIONE1-Benzoylacetonebenzoyl acetoneBenzoyl-acetonMFCD000087861-phenyl-butane-1,3-dione.alpha.-AcetylacetophenoneDTXSID3021803NSC 4015AI3-10572NSC-4015NSC-100655Benzoyl-aceton [German]NSC-83580NSC-83581NSC-87898NSC-88942NSC-97232
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