CS-1023829
3-(1-Methyl-1H-imidazol-4-yl)-2-(methylsulfonyl)-3-oxopropanenitrile
Manufacturer: ChemScene
CAS Number: 1690873-06-3
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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
C₈H₉N₃O₃S
Molecular Weight
227.24
Synonyms
None
SMILES
N#CC(C(=O)C=1N=CN(C1)C)S(=O)(=O)C
Tpsa
92.82
Logp
-0.46042
H Acceptors
6
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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₉N₃O₃S
Molecular Weight: 227.24
Synonyms: None
SMILES: N#CC(C(=O)C=1N=CN(C1)C)S(=O)(=O)C
Tpsa: 92.82
Logp: -0.46042
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:
C₈H₉N₃O₃S
Molecular Weight:
227.24
Synonyms:
None
SMILES:
N#CC(C(=O)C=1N=CN(C1)C)S(=O)(=O)C
Tpsa:
92.82
Logp:
-0.46042
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: C₁₁H₉BrN₂O
Molecular Weight: 265.11
Synonyms: None
SMILES: O=CC1=CC=C(C(Br)=C1)N2N=C(C=C2)C
Tpsa: 34.89
Logp: 2.75572
H Acceptors: 3
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:
C₁₁H₉BrN₂O
Molecular Weight:
265.11
Synonyms:
None
SMILES:
O=CC1=CC=C(C(Br)=C1)N2N=C(C=C2)C
Tpsa:
34.89
Logp:
2.75572
H Acceptors:
3
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: C₆H₁₁BrN₄O
Molecular Weight: 235.08
Synonyms: None
SMILES: BrC1=NC(=NN1CC(OC)C)N
Tpsa: 65.96
Logp: 0.6577
H Acceptors: 5
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:
C₆H₁₁BrN₄O
Molecular Weight:
235.08
Synonyms:
None
SMILES:
BrC1=NC(=NN1CC(OC)C)N
Tpsa:
65.96
Logp:
0.6577
H Acceptors:
5
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: C₇H₁₃N₃
Molecular Weight: 139.20
Synonyms: None
SMILES: N1=C2NC(C)CN2CCC1
Tpsa: 27.63
Logp: 0.0398
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:
C₇H₁₃N₃
Molecular Weight:
139.20
Synonyms:
None
SMILES:
N1=C2NC(C)CN2CCC1
Tpsa:
27.63
Logp:
0.0398
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0