CS-0514792
Calcium phenylpyruvate
Manufacturer: ChemScene
CAS Number: 54865-40-6
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₈H₁₄CaO₆
Molecular Weight
366.38
Synonyms
Phenylpyruvic acid calcium salt
SMILES
O=C(CC1=CC=CC=C1)C([O-])=O.O=C(CC2=CC=CC=C2)C([O-])=O.[Ca+2]
Tpsa
114.4
Logp
-1.2846
H Acceptors
6
H Donors
0
Rotatable Bonds
6
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 54865-40-6 | Calcium phenylpyruvate | A2B Chem | -- |
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SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₁₄CaO₆
Molecular Weight: 366.38
Synonyms: Phenylpyruvic acid calcium salt
SMILES: O=C(CC1=CC=CC=C1)C([O-])=O.O=C(CC2=CC=CC=C2)C([O-])=O.[Ca+2]
Tpsa: 114.4
Logp: -1.2846
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₄CaO₆
Molecular Weight:
366.38
Synonyms:
Phenylpyruvic acid calcium salt
SMILES:
O=C(CC1=CC=CC=C1)C([O-])=O.O=C(CC2=CC=CC=C2)C([O-])=O.[Ca+2]
Tpsa:
114.4
Logp:
-1.2846
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₄FN₃
Molecular Weight: 267.30
Synonyms: 5-AMINO-1-(4-FLUOROPHENYL)-3-(2-METHYLBENZENE)-1H-PYRAZOLE
SMILES: FC1=CC=C(C=C1)N2N=C(C=C2N)C=3C=CC=CC3C
Tpsa: 43.84
Logp: 3.56902
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₄FN₃
Molecular Weight:
267.30
Synonyms:
5-AMINO-1-(4-FLUOROPHENYL)-3-(2-METHYLBENZENE)-1H-PYRAZOLE
SMILES:
FC1=CC=C(C=C1)N2N=C(C=C2N)C=3C=CC=CC3C
Tpsa:
43.84
Logp:
3.56902
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD28505570
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₁₅NO₆
Molecular Weight: 413.38
Synonyms: None
SMILES: O=C1OC2(C3=CC(C(NCC#C)=O)=CC=C13)C4=CC=C(C=C4OC5=CC(O)=CC=C52)O
Tpsa: 105.09
Logp: 3.0288
H Acceptors: 6
H Donors: 3
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD28505570
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₁₅NO₆
Molecular Weight:
413.38
Synonyms:
None
SMILES:
O=C1OC2(C3=CC(C(NCC#C)=O)=CC=C13)C4=CC=C(C=C4OC5=CC(O)=CC=C52)O
Tpsa:
105.09
Logp:
3.0288
H Acceptors:
6
H Donors:
3
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD22192557
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₇Cl₂FO
Molecular Weight: 269.10
Synonyms: None
SMILES: O=CC1=CC=C(C2=CC(Cl)=CC(Cl)=C2)C=C1F
Tpsa: 17.07
Logp: 4.612
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD22192557
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₇Cl₂FO
Molecular Weight:
269.10
Synonyms:
None
SMILES:
O=CC1=CC=C(C2=CC(Cl)=CC(Cl)=C2)C=C1F
Tpsa:
17.07
Logp:
4.612
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
2