CS-0542507
Ethyl 2-bromo-5,7-dioxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxylate
Manufacturer: ChemScene
CAS Number: 2648449-73-2
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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
C₉H₈BrN₃O₄
Molecular Weight
302.08
Synonyms
Pyrazolo[1,5-a]pyrimidine-3-carboxylic acid, 2-bromo-4,5,6,7-tetrahydro-5,7-dioxo-, ethyl ester
SMILES
O=C(C(C(Br)=NN1C(C2)=O)=C1NC2=O)OCC
Tpsa
90.29
Logp
0.8047
H Acceptors
6
H Donors
1
Rotatable Bonds
2
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: C₉H₈BrN₃O₄
Molecular Weight: 302.08
Synonyms: Pyrazolo[1,5-a]pyrimidine-3-carboxylic acid, 2-bromo-4,5,6,7-tetrahydro-5,7-dioxo-, ethyl ester
SMILES: O=C(C(C(Br)=NN1C(C2)=O)=C1NC2=O)OCC
Tpsa: 90.29
Logp: 0.8047
H Acceptors: 6
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:
C₉H₈BrN₃O₄
Molecular Weight:
302.08
Synonyms:
Pyrazolo[1,5-a]pyrimidine-3-carboxylic acid, 2-bromo-4,5,6,7-tetrahydro-5,7-dioxo-, ethyl ester
SMILES:
O=C(C(C(Br)=NN1C(C2)=O)=C1NC2=O)OCC
Tpsa:
90.29
Logp:
0.8047
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD01320174
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₇F₃O₃
Molecular Weight: 184.11
Synonyms: 5-Oxo-6,6,6-trifluorohexanoic acid
SMILES: O=C(CCCC(C(F)(F)F)=O)O
Tpsa: 54.37
Logp: 1.3727
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
MFCD01320174
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₇F₃O₃
Molecular Weight:
184.11
Synonyms:
5-Oxo-6,6,6-trifluorohexanoic acid
SMILES:
O=C(CCCC(C(F)(F)F)=O)O
Tpsa:
54.37
Logp:
1.3727
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₅NO
Molecular Weight: 129.20
Synonyms: None
SMILES: OCC1(C)N(CCC1)C
Tpsa: 23.47
Logp: 0.463
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₅NO
Molecular Weight:
129.20
Synonyms:
None
SMILES:
OCC1(C)N(CCC1)C
Tpsa:
23.47
Logp:
0.463
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₇F₆NO₂
Molecular Weight: 287.16
Synonyms: None
SMILES: O=C(OC)C1=C(C(F)(F)F)C=C(C(F)(F)F)C=C1N
Tpsa: 52.32
Logp: 3.093
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₇F₆NO₂
Molecular Weight:
287.16
Synonyms:
None
SMILES:
O=C(OC)C1=C(C(F)(F)F)C=C(C(F)(F)F)C=C1N
Tpsa:
52.32
Logp:
3.093
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1