CS-1038894
5-Bromo-2-(but-3-yn-1-ylamino)isonicotinic acid
Manufacturer: ChemScene
CAS Number: 1876268-24-4
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₀H₉BrN₂O₂
Molecular Weight
269.09
Synonyms
None
SMILES
O=C(O)C1=CC(=NC=C1Br)NCCC#C
Tpsa
62.22
Logp
1.9775
H Acceptors
3
H Donors
2
Rotatable Bonds
4
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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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₉BrN₂O₂
Molecular Weight: 269.09
Synonyms: None
SMILES: O=C(O)C1=CC(=NC=C1Br)NCCC#C
Tpsa: 62.22
Logp: 1.9775
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:
C₁₀H₉BrN₂O₂
Molecular Weight:
269.09
Synonyms:
None
SMILES:
O=C(O)C1=CC(=NC=C1Br)NCCC#C
Tpsa:
62.22
Logp:
1.9775
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: C₈H₆IN₃O₂S
Molecular Weight: 335.12
Synonyms: None
SMILES: O=CC=1SC(=NC1N2N=CC(I)=C2)OC
Tpsa: 57.01
Logp: 1.7545
H Acceptors: 6
H Donors: 0
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:
C₈H₆IN₃O₂S
Molecular Weight:
335.12
Synonyms:
None
SMILES:
O=CC=1SC(=NC1N2N=CC(I)=C2)OC
Tpsa:
57.01
Logp:
1.7545
H Acceptors:
6
H Donors:
0
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: C₁₃H₂₁NO
Molecular Weight: 207.31
Synonyms: None
SMILES: N#CC1OC21CCC(CC2)C(C)(C)CC
Tpsa: 36.32
Logp: 3.27398
H Acceptors: 2
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:
C₁₃H₂₁NO
Molecular Weight:
207.31
Synonyms:
None
SMILES:
N#CC1OC21CCC(CC2)C(C)(C)CC
Tpsa:
36.32
Logp:
3.27398
H Acceptors:
2
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: C₆H₄ClFNaO₂S
Molecular Weight: 217.60
Synonyms: None
SMILES: [Na].O=S(O)C=1C=C(F)C=C(Cl)C1
Tpsa: 37.3
Logp: 1.6789
H Acceptors: 1
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:
C₆H₄ClFNaO₂S
Molecular Weight:
217.60
Synonyms:
None
SMILES:
[Na].O=S(O)C=1C=C(F)C=C(Cl)C1
Tpsa:
37.3
Logp:
1.6789
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
1