CS-0529764
2-Bromo-1H-pyrrolo[2,3-b]pyridine-6-carbonitrile
Manufacturer: ChemScene
CAS Number: 2092825-87-9
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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
C₈H₄BrN₃
Molecular Weight
222.04
Synonyms
None
SMILES
N#CC1=CC=C2C(NC(Br)=C2)=N1
Tpsa
52.47
Logp
2.19708
H Acceptors
2
H Donors
1
Rotatable Bonds
0
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SAFETY INFORMATION
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-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: C₈H₄BrN₃
Molecular Weight: 222.04
Synonyms: None
SMILES: N#CC1=CC=C2C(NC(Br)=C2)=N1
Tpsa: 52.47
Logp: 2.19708
H Acceptors: 2
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:
C₈H₄BrN₃
Molecular Weight:
222.04
Synonyms:
None
SMILES:
N#CC1=CC=C2C(NC(Br)=C2)=N1
Tpsa:
52.47
Logp:
2.19708
H Acceptors:
2
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: C₄H₁₀O₃S
Molecular Weight: 138.19
Synonyms: tert-butyl sulfonic acid
SMILES: CC(S(=O)(O)=O)(C)C
Tpsa: 54.37
Logp: 0.6727
H Acceptors: 2
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:
C₄H₁₀O₃S
Molecular Weight:
138.19
Synonyms:
tert-butyl sulfonic acid
SMILES:
CC(S(=O)(O)=O)(C)C
Tpsa:
54.37
Logp:
0.6727
H Acceptors:
2
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: C₄H₁₂ClNO₂
Molecular Weight: 141.60
Synonyms: None
SMILES: NCC[C@@H](O)CO.Cl
Tpsa: 66.48
Logp: -0.8898
H Acceptors: 3
H Donors: 3
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:
C₄H₁₂ClNO₂
Molecular Weight:
141.60
Synonyms:
None
SMILES:
NCC[C@@H](O)CO.Cl
Tpsa:
66.48
Logp:
-0.8898
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₉ClN₂O₄
Molecular Weight: 256.64
Synonyms: None
SMILES: O=C1N(C2=CC=C([N+]([O-])=O)C=C2Cl)CCOC1
Tpsa: 72.68
Logp: 1.6114
H Acceptors: 4
H Donors: 0
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:
C₁₀H₉ClN₂O₄
Molecular Weight:
256.64
Synonyms:
None
SMILES:
O=C1N(C2=CC=C([N+]([O-])=O)C=C2Cl)CCOC1
Tpsa:
72.68
Logp:
1.6114
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2