CS-0540936
Methyl 6-((methylsulfonyl)methyl)nicotinate
Manufacturer: ChemScene
CAS Number: 597562-53-3
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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
C₉H₁₁NO₄S
Molecular Weight
229.25
Synonyms
None
SMILES
O=C(C1=CC=C(CS(=O)(C)=O)N=C1)OC
Tpsa
73.33
Logp
0.4128
H Acceptors
5
H Donors
0
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: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₁NO₄S
Molecular Weight: 229.25
Synonyms: None
SMILES: O=C(C1=CC=C(CS(=O)(C)=O)N=C1)OC
Tpsa: 73.33
Logp: 0.4128
H Acceptors: 5
H Donors: 0
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:
C₉H₁₁NO₄S
Molecular Weight:
229.25
Synonyms:
None
SMILES:
O=C(C1=CC=C(CS(=O)(C)=O)N=C1)OC
Tpsa:
73.33
Logp:
0.4128
H Acceptors:
5
H Donors:
0
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: C₉H₈N₂O₄
Molecular Weight: 208.17
Synonyms: methyl 2-oxo-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-formate
SMILES: COC(=O)C1=CC2=C(N=C1)OCC(=O)N2
Tpsa: 77.52
Logp: 0.1991
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:
C₉H₈N₂O₄
Molecular Weight:
208.17
Synonyms:
methyl 2-oxo-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine-7-formate
SMILES:
COC(=O)C1=CC2=C(N=C1)OCC(=O)N2
Tpsa:
77.52
Logp:
0.1991
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: C₈H₈O₂S
Molecular Weight: 168.21
Synonyms: 2-methylsulfinylbenzaldehyde
SMILES: CS(=O)C1=CC=CC=C1C=O
Tpsa: 34.14
Logp: 1.2365
H Acceptors: 2
H Donors: 0
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:
C₈H₈O₂S
Molecular Weight:
168.21
Synonyms:
2-methylsulfinylbenzaldehyde
SMILES:
CS(=O)C1=CC=CC=C1C=O
Tpsa:
34.14
Logp:
1.2365
H Acceptors:
2
H Donors:
0
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: C₈H₁₄N₂
Molecular Weight: 138.21
Synonyms: N,4-Dimethyl-4-cyanopiperidin
SMILES: CC1(CCN(CC1)C)C#N
Tpsa: 27.03
Logp: 1.24188
H Acceptors: 2
H Donors: 0
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:
C₈H₁₄N₂
Molecular Weight:
138.21
Synonyms:
N,4-Dimethyl-4-cyanopiperidin
SMILES:
CC1(CCN(CC1)C)C#N
Tpsa:
27.03
Logp:
1.24188
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0