CS-1047230
1H-Pyrrole-2-carboxylic acid, 5-chloro-4-fluoro-, methyl ester
Manufacturer: ChemScene
CAS Number: 3031416-01-7
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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
C₆H₅ClFNO₂
Molecular Weight
177.56
Synonyms
None
SMILES
O=C(C1=CC(F)=C(Cl)N1)OC
Tpsa
42.09
Logp
1.5938
H Acceptors
2
H Donors
1
Rotatable Bonds
1
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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: C₆H₅ClFNO₂
Molecular Weight: 177.56
Synonyms: None
SMILES: O=C(C1=CC(F)=C(Cl)N1)OC
Tpsa: 42.09
Logp: 1.5938
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:
C₆H₅ClFNO₂
Molecular Weight:
177.56
Synonyms:
None
SMILES:
O=C(C1=CC(F)=C(Cl)N1)OC
Tpsa:
42.09
Logp:
1.5938
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: C₂₂H₂₁NO₅
Molecular Weight: 379.41
Synonyms: None
SMILES: O=C(C12COC(C2)(CNC(OCC3C4=C(C5=C3C=CC=C5)C=CC=C4)=O)C1)O
Tpsa: 84.86
Logp: 3.1589
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₂₁NO₅
Molecular Weight:
379.41
Synonyms:
None
SMILES:
O=C(C12COC(C2)(CNC(OCC3C4=C(C5=C3C=CC=C5)C=CC=C4)=O)C1)O
Tpsa:
84.86
Logp:
3.1589
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₄BrN₃O
Molecular Weight: 238.04
Synonyms: None
SMILES: N#CC1=C(O)C2=C(Br)C=CN2N=C1
Tpsa: 61.32
Logp: 1.67408
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₄BrN₃O
Molecular Weight:
238.04
Synonyms:
None
SMILES:
N#CC1=C(O)C2=C(Br)C=CN2N=C1
Tpsa:
61.32
Logp:
1.67408
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₅NO₂
Molecular Weight: 181.23
Synonyms: None
SMILES: O=C(O)/C=C/C12CCCN1CCC2
Tpsa: 40.54
Logp: 1.2556
H Acceptors: 2
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:
C₁₀H₁₅NO₂
Molecular Weight:
181.23
Synonyms:
None
SMILES:
O=C(O)/C=C/C12CCCN1CCC2
Tpsa:
40.54
Logp:
1.2556
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2