CS-1143630
6-(1,3-Dioxolan-2-yl)nicotinic acid
Manufacturer: ChemScene
CAS Number: 849790-40-5
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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
C₉H₉NO₄
Molecular Weight
195.17
Synonyms
None
SMILES
O=C(O)C1=CN=C(C=C1)C2OCCO2
Tpsa
68.65
Logp
0.8252
H Acceptors
4
H Donors
1
Rotatable Bonds
2
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: C₉H₉NO₄
Molecular Weight: 195.17
Synonyms: None
SMILES: O=C(O)C1=CN=C(C=C1)C2OCCO2
Tpsa: 68.65
Logp: 0.8252
H Acceptors: 4
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:
C₉H₉NO₄
Molecular Weight:
195.17
Synonyms:
None
SMILES:
O=C(O)C1=CN=C(C=C1)C2OCCO2
Tpsa:
68.65
Logp:
0.8252
H Acceptors:
4
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: C₄H₆F₃N₃
Molecular Weight: 153.11
Synonyms: None
SMILES: FC(F)(F)N1N=C(N)CC1
Tpsa: 41.62
Logp: 0.4841
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:
C₄H₆F₃N₃
Molecular Weight:
153.11
Synonyms:
None
SMILES:
FC(F)(F)N1N=C(N)CC1
Tpsa:
41.62
Logp:
0.4841
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₂N₂O₄
Molecular Weight: 236.23
Synonyms: None
SMILES: O=C(O)C(N)CC1=CC=C2C(OC(=O)N2C)=C1
Tpsa: 98.46
Logp: 0.0859
H Acceptors: 5
H Donors: 2
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:
C₁₁H₁₂N₂O₄
Molecular Weight:
236.23
Synonyms:
None
SMILES:
O=C(O)C(N)CC1=CC=C2C(OC(=O)N2C)=C1
Tpsa:
98.46
Logp:
0.0859
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: C₈H₁₃FO₂
Molecular Weight: 160.19
Synonyms: None
SMILES: C(O)(=O)[C@H]1C[C@@H](CF)CCC1
Tpsa: 37.3
Logp: 1.8469
H Acceptors: 1
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:
C₈H₁₃FO₂
Molecular Weight:
160.19
Synonyms:
None
SMILES:
C(O)(=O)[C@H]1C[C@@H](CF)CCC1
Tpsa:
37.3
Logp:
1.8469
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
2