CS-0542464
2-Bromo-6-cyanoisonicotinic acid
Manufacturer: ChemScene
CAS Number: 1393569-72-6
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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
C₇H₃BrN₂O₂
Molecular Weight
227.01
Synonyms
None
SMILES
N#CC1=NC(Br)=CC(C(O)=O)=C1
Tpsa
73.98
Logp
1.41398
H Acceptors
3
H Donors
1
Rotatable Bonds
1
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: C₇H₃BrN₂O₂
Molecular Weight: 227.01
Synonyms: None
SMILES: N#CC1=NC(Br)=CC(C(O)=O)=C1
Tpsa: 73.98
Logp: 1.41398
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:
C₇H₃BrN₂O₂
Molecular Weight:
227.01
Synonyms:
None
SMILES:
N#CC1=NC(Br)=CC(C(O)=O)=C1
Tpsa:
73.98
Logp:
1.41398
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: C₇H₇N₃
Molecular Weight: 133.15
Synonyms: None
SMILES: NC1=CC2=CN=CN2C=C1
Tpsa: 43.32
Logp: 0.9165
H Acceptors: 3
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:
C₇H₇N₃
Molecular Weight:
133.15
Synonyms:
None
SMILES:
NC1=CC2=CN=CN2C=C1
Tpsa:
43.32
Logp:
0.9165
H Acceptors:
3
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: C₆H₉NO₃
Molecular Weight: 143.14
Synonyms: None
SMILES: O[C@H]1[C@]2([H])N(CC1)C(OC2)=O
Tpsa: 49.77
Logp: -0.4282
H Acceptors: 3
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:
C₆H₉NO₃
Molecular Weight:
143.14
Synonyms:
None
SMILES:
O[C@H]1[C@]2([H])N(CC1)C(OC2)=O
Tpsa:
49.77
Logp:
-0.4282
H Acceptors:
3
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: C₇H₅F₂NO₂
Molecular Weight: 173.12
Synonyms: None
SMILES: O=C(O)C1=CC=C(F)C(N)=C1F
Tpsa: 63.32
Logp: 1.2452
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:
C₇H₅F₂NO₂
Molecular Weight:
173.12
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(F)C(N)=C1F
Tpsa:
63.32
Logp:
1.2452
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1