CS-0766229
3,5-Dinitroisonicotinic Acid
Manufacturer: ChemScene
CAS Number: 191017-95-5
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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
C₆H₃N₃O₆
Molecular Weight
213.10
Synonyms
None
SMILES
OC(=O)C1=C(C=NC=C1[N+]([O-])=O)[N+]([O-])=O
Tpsa
136.47
Logp
0.5962
H Acceptors
6
H Donors
1
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: C₆H₃N₃O₆
Molecular Weight: 213.10
Synonyms: None
SMILES: OC(=O)C1=C(C=NC=C1[N+]([O-])=O)[N+]([O-])=O
Tpsa: 136.47
Logp: 0.5962
H Acceptors: 6
H Donors: 1
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:
C₆H₃N₃O₆
Molecular Weight:
213.10
Synonyms:
None
SMILES:
OC(=O)C1=C(C=NC=C1[N+]([O-])=O)[N+]([O-])=O
Tpsa:
136.47
Logp:
0.5962
H Acceptors:
6
H Donors:
1
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: C₁₃H₁₃BrN₂O₂S
Molecular Weight: 341.22
Synonyms: None
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NNC1=C(Br)C=CC=C1
Tpsa: 58.2
Logp: 3.06292
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₃BrN₂O₂S
Molecular Weight:
341.22
Synonyms:
None
SMILES:
CC1=CC=C(C=C1)S(=O)(=O)NNC1=C(Br)C=CC=C1
Tpsa:
58.2
Logp:
3.06292
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
4
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₈N₄O
Molecular Weight: 152.15
Synonyms: None
SMILES: O=CC1=NN=C2CNCCN12
Tpsa: 59.81
Logp: -0.8062
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 1
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₈N₄O
Molecular Weight:
152.15
Synonyms:
None
SMILES:
O=CC1=NN=C2CNCCN12
Tpsa:
59.81
Logp:
-0.8062
H Acceptors:
5
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: C₁₆H₂₃BrN₂O₂
Molecular Weight: 355.27
Synonyms: None
SMILES: CC(C)(C)OC(=O)N1CCC(CC1)NC1=C(Br)C=CC=C1
Tpsa: 41.57
Logp: 4.2605
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:
C₁₆H₂₃BrN₂O₂
Molecular Weight:
355.27
Synonyms:
None
SMILES:
CC(C)(C)OC(=O)N1CCC(CC1)NC1=C(Br)C=CC=C1
Tpsa:
41.57
Logp:
4.2605
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2