CS-1043155
5-Bromo-6-((tert-butoxycarbonyl)amino)nicotinic acid
Manufacturer: ChemScene
CAS Number: 1936097-63-0
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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
C₁₁H₁₃BrN₂O₄
Molecular Weight
317.14
Synonyms
None
SMILES
O=C(O)C1=CN=C(NC(=O)OC(C)(C)C)C(Br)=C1
Tpsa
88.52
Logp
2.8893
H Acceptors
4
H Donors
2
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
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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: C₁₁H₁₃BrN₂O₄
Molecular Weight: 317.14
Synonyms: None
SMILES: O=C(O)C1=CN=C(NC(=O)OC(C)(C)C)C(Br)=C1
Tpsa: 88.52
Logp: 2.8893
H Acceptors: 4
H Donors: 2
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:
C₁₁H₁₃BrN₂O₄
Molecular Weight:
317.14
Synonyms:
None
SMILES:
O=C(O)C1=CN=C(NC(=O)OC(C)(C)C)C(Br)=C1
Tpsa:
88.52
Logp:
2.8893
H Acceptors:
4
H Donors:
2
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: C₈H₁₂N₂O₂S
Molecular Weight: 200.26
Synonyms: None
SMILES: O=S(=O)(N)CCC1=NC=C(C=C1)C
Tpsa: 73.05
Logp: 0.22102
H Acceptors: 3
H Donors: 1
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:
C₈H₁₂N₂O₂S
Molecular Weight:
200.26
Synonyms:
None
SMILES:
O=S(=O)(N)CCC1=NC=C(C=C1)C
Tpsa:
73.05
Logp:
0.22102
H Acceptors:
3
H Donors:
1
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: C₆H₇NO₃S
Molecular Weight: 173.19
Synonyms: None
SMILES: O=C(O)CC=1SN=C(OC)C1
Tpsa: 59.42
Logp: 0.7788
H Acceptors: 4
H Donors: 1
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:
C₆H₇NO₃S
Molecular Weight:
173.19
Synonyms:
None
SMILES:
O=C(O)CC=1SN=C(OC)C1
Tpsa:
59.42
Logp:
0.7788
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₂ClN₃O₂
Molecular Weight: 253.68
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1C=CC=2N=C(Cl)N=CC21
Tpsa: 57.01
Logp: 2.8679
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 0
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₂ClN₃O₂
Molecular Weight:
253.68
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1C=CC=2N=C(Cl)N=CC21
Tpsa:
57.01
Logp:
2.8679
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
0