CS-0654389
3-Methyl-5-(methylsulfonyl)-1H-pyrrole-2-carboxylic acid
Manufacturer: ChemScene
CAS Number: 2730026-69-2
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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
C₇H₉NO₄S
Molecular Weight
203.22
Synonyms
None
SMILES
O=C(C1=C(C)C=C(S(=O)(C)=O)N1)O
Tpsa
87.23
Logp
0.42482
H Acceptors
3
H Donors
2
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: C₇H₉NO₄S
Molecular Weight: 203.22
Synonyms: None
SMILES: O=C(C1=C(C)C=C(S(=O)(C)=O)N1)O
Tpsa: 87.23
Logp: 0.42482
H Acceptors: 3
H Donors: 2
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:
C₇H₉NO₄S
Molecular Weight:
203.22
Synonyms:
None
SMILES:
O=C(C1=C(C)C=C(S(=O)(C)=O)N1)O
Tpsa:
87.23
Logp:
0.42482
H Acceptors:
3
H Donors:
2
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: C₉H₁₁ClN₂O₂
Molecular Weight: 214.65
Synonyms: None
SMILES: O=C(C1=CN=C(CCCC2)C2=N1)O.Cl
Tpsa: 63.08
Logp: 1.4754
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:
C₉H₁₁ClN₂O₂
Molecular Weight:
214.65
Synonyms:
None
SMILES:
O=C(C1=CN=C(CCCC2)C2=N1)O.Cl
Tpsa:
63.08
Logp:
1.4754
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: C₆H₈ClN₃O₂
Molecular Weight: 189.60
Synonyms: None
SMILES: O=C(C1=NC=C(N)N=C1C)O.Cl
Tpsa: 89.1
Logp: 0.48722
H Acceptors: 4
H Donors: 2
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:
C₆H₈ClN₃O₂
Molecular Weight:
189.60
Synonyms:
None
SMILES:
O=C(C1=NC=C(N)N=C1C)O.Cl
Tpsa:
89.1
Logp:
0.48722
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: -20°C, sealed storage, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄H₂ClF₃N₄
Molecular Weight: 198.53
Synonyms: None
SMILES: NC1=NC(Cl)=NC(C(F)(F)F)=N1
Tpsa: 64.69
Logp: 1.126
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
-20°C, sealed storage, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₂ClF₃N₄
Molecular Weight:
198.53
Synonyms:
None
SMILES:
NC1=NC(Cl)=NC(C(F)(F)F)=N1
Tpsa:
64.69
Logp:
1.126
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
0