CS-0004374
1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid, 3-(cyanomethyl)-, methyl ester
Manufacturer: ChemScene
CAS Number: 1204475-79-5
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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
C₁₁H₉N₃O₂
Molecular Weight
215.21
Synonyms
None
SMILES
N#CCC1=C(C(OC)=O)NC2=NC=CC=C12
Tpsa
78.77
Logp
1.41558
H Acceptors
4
H Donors
1
Rotatable Bonds
2
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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: C₁₁H₉N₃O₂
Molecular Weight: 215.21
Synonyms: None
SMILES: N#CCC1=C(C(OC)=O)NC2=NC=CC=C12
Tpsa: 78.77
Logp: 1.41558
H Acceptors: 4
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:
C₁₁H₉N₃O₂
Molecular Weight:
215.21
Synonyms:
None
SMILES:
N#CCC1=C(C(OC)=O)NC2=NC=CC=C12
Tpsa:
78.77
Logp:
1.41558
H Acceptors:
4
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: C₁₀H₈F₂N₂O₂
Molecular Weight: 226.18
Synonyms: None
SMILES: O=C(OC)C1=C(C(F)F)C2=CC=CN=C2N1
Tpsa: 54.98
Logp: 2.2871
H Acceptors: 3
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:
C₁₀H₈F₂N₂O₂
Molecular Weight:
226.18
Synonyms:
None
SMILES:
O=C(OC)C1=C(C(F)F)C2=CC=CN=C2N1
Tpsa:
54.98
Logp:
2.2871
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₈N₂O₃
Molecular Weight: 204.18
Synonyms: None
SMILES: O=C(OC)C1=C(C=O)C2=CC=CN=C2N1
Tpsa: 72.05
Logp: 1.162
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₈N₂O₃
Molecular Weight:
204.18
Synonyms:
None
SMILES:
O=C(OC)C1=C(C=O)C2=CC=CN=C2N1
Tpsa:
72.05
Logp:
1.162
H Acceptors:
4
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: C₉H₅F₃N₂O₂
Molecular Weight: 230.14
Synonyms: None
SMILES: O=C(O)C(NC1=NC=CC=C12)=C2C(F)(F)F
Tpsa: 65.98
Logp: 2.2799
H Acceptors: 2
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:
C₉H₅F₃N₂O₂
Molecular Weight:
230.14
Synonyms:
None
SMILES:
O=C(O)C(NC1=NC=CC=C12)=C2C(F)(F)F
Tpsa:
65.98
Logp:
2.2799
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1