CS-0373231
Ethyl 7-bromo-2,4,6-trichloro-8-fluoroquinoline-3-carboxylate
Manufacturer: ChemScene
CAS Number: 2728716-46-7
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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
C₁₂H₆BrCl₃FNO₂
Molecular Weight
401.44
Synonyms
3-Quinolinecarboxylic acid, 7-bromo-2,4,6-trichloro-8-fluoro-, ethyl ester
SMILES
O=C(C1=C(Cl)C2=CC(Cl)=C(Br)C(F)=C2N=C1Cl)OCC
Tpsa
39.19
Logp
5.2733
H Acceptors
3
H Donors
0
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: C₁₂H₆BrCl₃FNO₂
Molecular Weight: 401.44
Synonyms: 3-Quinolinecarboxylic acid, 7-bromo-2,4,6-trichloro-8-fluoro-, ethyl ester
SMILES: O=C(C1=C(Cl)C2=CC(Cl)=C(Br)C(F)=C2N=C1Cl)OCC
Tpsa: 39.19
Logp: 5.2733
H Acceptors: 3
H Donors: 0
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:
C₁₂H₆BrCl₃FNO₂
Molecular Weight:
401.44
Synonyms:
3-Quinolinecarboxylic acid, 7-bromo-2,4,6-trichloro-8-fluoro-, ethyl ester
SMILES:
O=C(C1=C(Cl)C2=CC(Cl)=C(Br)C(F)=C2N=C1Cl)OCC
Tpsa:
39.19
Logp:
5.2733
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄H₂N₄O₂
Molecular Weight: 138.08
Synonyms: 3-Nitro-1H-pyrazole-5-carbonitrile
SMILES: N#CC1=NNC([N+]([O-])=O)=C1
Tpsa: 95.61
Logp: 0.18958
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₂N₄O₂
Molecular Weight:
138.08
Synonyms:
3-Nitro-1H-pyrazole-5-carbonitrile
SMILES:
N#CC1=NNC([N+]([O-])=O)=C1
Tpsa:
95.61
Logp:
0.18958
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1
Purity: 96%
MDL No: MFCD11553050
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₆O₄
Molecular Weight: 188.22
Synonyms: dimethyldimethylpentanedioate
SMILES: O=C(OC)C(C)(C)CCC(OC)=O
Tpsa: 52.6
Logp: 1.1388
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 4
Purity:
96%
MDL No:
MFCD11553050
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₆O₄
Molecular Weight:
188.22
Synonyms:
dimethyldimethylpentanedioate
SMILES:
O=C(OC)C(C)(C)CCC(OC)=O
Tpsa:
52.6
Logp:
1.1388
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: MFCD06660352
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₃ClF₃N
Molecular Weight: 205.56
Synonyms: 3-Cyano-4-trifluoromethyl-1-chlorobenzene
SMILES: N#CC1=CC(Cl)=CC=C1C(F)(F)F
Tpsa: 23.79
Logp: 3.23048
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
MFCD06660352
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₃ClF₃N
Molecular Weight:
205.56
Synonyms:
3-Cyano-4-trifluoromethyl-1-chlorobenzene
SMILES:
N#CC1=CC(Cl)=CC=C1C(F)(F)F
Tpsa:
23.79
Logp:
3.23048
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0