CS-0004031
1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid, 3-cyano-
Manufacturer: ChemScene
CAS Number: 1204475-69-3
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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
C₉H₅N₃O₂
Molecular Weight
187.15
Synonyms
None
SMILES
N#CC1=C(C(O)=O)NC2=NC=CC=C12
Tpsa
89.77
Logp
1.13278
H Acceptors
3
H Donors
2
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: C₉H₅N₃O₂
Molecular Weight: 187.15
Synonyms: None
SMILES: N#CC1=C(C(O)=O)NC2=NC=CC=C12
Tpsa: 89.77
Logp: 1.13278
H Acceptors: 3
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:
C₉H₅N₃O₂
Molecular Weight:
187.15
Synonyms:
None
SMILES:
N#CC1=C(C(O)=O)NC2=NC=CC=C12
Tpsa:
89.77
Logp:
1.13278
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD12827805
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₂F₃N₃
Molecular Weight: 267.25
Synonyms: 1-(tert-Butyl)-4-(trifluoromethyl)-1H-pyrrolo-[2,3-b]pyridine-3-carbonitrile
SMILES: N#CC1=CN(C(C)(C)C)C2=NC=CC(C(F)(F)F)=C21
Tpsa: 41.61
Logp: 3.68178
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
MFCD12827805
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₂F₃N₃
Molecular Weight:
267.25
Synonyms:
1-(tert-Butyl)-4-(trifluoromethyl)-1H-pyrrolo-[2,3-b]pyridine-3-carbonitrile
SMILES:
N#CC1=CN(C(C)(C)C)C2=NC=CC(C(F)(F)F)=C21
Tpsa:
41.61
Logp:
3.68178
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0
Purity: 95+%
MDL No: MFCD12827797
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₄F₃N₃
Molecular Weight: 281.28
Synonyms: 1-(tert-butyl)-6-methyl-4-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile
SMILES: N#CC1=CN(C(C)(C)C)C2=NC(C)=CC(C(F)(F)F)=C12
Tpsa: 41.61
Logp: 3.9902
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
95+%
MDL No:
MFCD12827797
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₄F₃N₃
Molecular Weight:
281.28
Synonyms:
1-(tert-butyl)-6-methyl-4-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile
SMILES:
N#CC1=CN(C(C)(C)C)C2=NC(C)=CC(C(F)(F)F)=C12
Tpsa:
41.61
Logp:
3.9902
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0
Purity: 95+%
MDL No: MFCD12827799
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₁F₆N₃
Molecular Weight: 335.25
Synonyms: 1-(tert-butyl)-4,6-bis(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile
SMILES: N#CC1=CN(C(C)(C)C)C2=NC(C(F)(F)F)=CC(C(F)(F)F)=C12
Tpsa: 41.61
Logp: 4.70058
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
95+%
MDL No:
MFCD12827799
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₁F₆N₃
Molecular Weight:
335.25
Synonyms:
1-(tert-butyl)-4,6-bis(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile
SMILES:
N#CC1=CN(C(C)(C)C)C2=NC(C(F)(F)F)=CC(C(F)(F)F)=C12
Tpsa:
41.61
Logp:
4.70058
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0