CS-0805371
4-(Aminomethyl)-5-cyano-6-(difluoromethyl)nicotinic acid
Manufacturer: ChemScene
CAS Number: 1805983-11-2
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Purity
98%
MDL No
MFCD25397614
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₉H₇F₂N₃O₂
Molecular Weight
227.17
Synonyms
None
SMILES
C1=C(C(=C(C(=N1)C(F)F)C#N)CN)C(=O)O
Tpsa
100
Logp
1.04778
H Acceptors
4
H Donors
2
Rotatable Bonds
3
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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: 98%
MDL No: MFCD25397614
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₇F₂N₃O₂
Molecular Weight: 227.17
Synonyms: None
SMILES: C1=C(C(=C(C(=N1)C(F)F)C#N)CN)C(=O)O
Tpsa: 100
Logp: 1.04778
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD25397614
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₇F₂N₃O₂
Molecular Weight:
227.17
Synonyms:
None
SMILES:
C1=C(C(=C(C(=N1)C(F)F)C#N)CN)C(=O)O
Tpsa:
100
Logp:
1.04778
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
3
Purity: 98%
MDL No: MFCD28161071
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₂BNO₄
Molecular Weight: 221.02
Synonyms: None
SMILES: B(C1=CC2=C(C=C1)NC(=O)OC2(C)C)(O)O
Tpsa: 78.79
Logp: 0.1636
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD28161071
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₂BNO₄
Molecular Weight:
221.02
Synonyms:
None
SMILES:
B(C1=CC2=C(C=C1)NC(=O)OC2(C)C)(O)O
Tpsa:
78.79
Logp:
0.1636
H Acceptors:
4
H Donors:
3
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: C₅H₆BNO₃S
Molecular Weight: 170.98
Synonyms: None
SMILES: B(C1=CSC(=C1)C(=O)N)(O)O
Tpsa: 83.55
Logp: -1.4732
H Acceptors: 4
H Donors: 3
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:
C₅H₆BNO₃S
Molecular Weight:
170.98
Synonyms:
None
SMILES:
B(C1=CSC(=C1)C(=O)N)(O)O
Tpsa:
83.55
Logp:
-1.4732
H Acceptors:
4
H Donors:
3
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: C₈H₁₃BN₂O₃
Molecular Weight: 196.01
Synonyms: None
SMILES: B(C1=CN=C(C=C1OC)N(C)C)(O)O
Tpsa: 65.82
Logp: -1.164
H Acceptors: 5
H Donors: 2
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:
C₈H₁₃BN₂O₃
Molecular Weight:
196.01
Synonyms:
None
SMILES:
B(C1=CN=C(C=C1OC)N(C)C)(O)O
Tpsa:
65.82
Logp:
-1.164
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
3