CS-0881147
2-(Ethoxycarbonyl)-1H-pyrrolo[2,3-c]pyridine-5-carboxylic acid
Manufacturer: ChemScene
CAS Number: 122631-04-3
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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
C₁₁H₁₀N₂O₄
Molecular Weight
234.21
Synonyms
None
SMILES
O=C(C(N1)=CC2=C1C=NC(C(O)=O)=C2)OCC
Tpsa
92.28
Logp
1.4378
H Acceptors
4
H Donors
2
Rotatable Bonds
3
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: C₁₁H₁₀N₂O₄
Molecular Weight: 234.21
Synonyms: None
SMILES: O=C(C(N1)=CC2=C1C=NC(C(O)=O)=C2)OCC
Tpsa: 92.28
Logp: 1.4378
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₀N₂O₄
Molecular Weight:
234.21
Synonyms:
None
SMILES:
O=C(C(N1)=CC2=C1C=NC(C(O)=O)=C2)OCC
Tpsa:
92.28
Logp:
1.4378
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₇NO₂
Molecular Weight: 207.27
Synonyms: None
SMILES: C#C[C@@H]1[C@@]2([H])[C@]1([H])CN(C2)C(OC(C)(C)C)=O
Tpsa: 29.54
Logp: 1.7325
H Acceptors: 2
H Donors: 0
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:
C₁₂H₁₇NO₂
Molecular Weight:
207.27
Synonyms:
None
SMILES:
C#C[C@@H]1[C@@]2([H])[C@]1([H])CN(C2)C(OC(C)(C)C)=O
Tpsa:
29.54
Logp:
1.7325
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: -20°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₅F₂NO₅S
Molecular Weight: 287.28
Synonyms: None
SMILES: O=C(N1S(OC[C@@H]1CC(F)F)(=O)=O)OC(C)(C)C
Tpsa: 72.91
Logp: 1.5223
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
-20°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₅F₂NO₅S
Molecular Weight:
287.28
Synonyms:
None
SMILES:
O=C(N1S(OC[C@@H]1CC(F)F)(=O)=O)OC(C)(C)C
Tpsa:
72.91
Logp:
1.5223
H Acceptors:
5
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: C₈H₁₆BF₃KNO₂
Molecular Weight: 265.12
Synonyms: None
SMILES: F[B-](F)(CCN(C(OC(C)(C)C)=O)C)F.[K+]
Tpsa: 29.54
Logp: -0.2953
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₆BF₃KNO₂
Molecular Weight:
265.12
Synonyms:
None
SMILES:
F[B-](F)(CCN(C(OC(C)(C)C)=O)C)F.[K+]
Tpsa:
29.54
Logp:
-0.2953
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
3