CS-0573235
4-Chloro-N-(2-(methylthio)phenyl)butanamide
Manufacturer: ChemScene
CAS Number: 65655-71-2
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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
C₁₁H₁₄ClNOS
Molecular Weight
243.75
Synonyms
None
SMILES
O=C(NC=1C=CC=CC1SC)CCCCl
Tpsa
29.1
Logp
3.366
H Acceptors
2
H Donors
1
Rotatable Bonds
5
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SAFETY INFORMATION
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-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: C₁₁H₁₄ClNOS
Molecular Weight: 243.75
Synonyms: None
SMILES: O=C(NC=1C=CC=CC1SC)CCCCl
Tpsa: 29.1
Logp: 3.366
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₄ClNOS
Molecular Weight:
243.75
Synonyms:
None
SMILES:
O=C(NC=1C=CC=CC1SC)CCCCl
Tpsa:
29.1
Logp:
3.366
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₂₁NO₈S₂
Molecular Weight: 395.45
Synonyms: Carbamicacid,[(1R)-3-[(methylsulfonyl)oxy]-1-[[(methylsulfonyl)oxy]methyl]propyl]-,phenylmethylester(9CI)
SMILES: CS(=O)(=O)OCC[C@H](COS(=O)(=O)C)NC(=O)OCC1=CC=CC=C1
Tpsa: 125.07
Logp: 0.6239
H Acceptors: 8
H Donors: 1
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₁NO₈S₂
Molecular Weight:
395.45
Synonyms:
Carbamicacid,[(1R)-3-[(methylsulfonyl)oxy]-1-[[(methylsulfonyl)oxy]methyl]propyl]-,phenylmethylester(9CI)
SMILES:
CS(=O)(=O)OCC[C@H](COS(=O)(=O)C)NC(=O)OCC1=CC=CC=C1
Tpsa:
125.07
Logp:
0.6239
H Acceptors:
8
H Donors:
1
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₀N₂O₂
Molecular Weight: 202.21
Synonyms: 1-methyl-4-phenyl-1H-imidazol-5-carboxylic acid
SMILES: CN1C=NC(=C1C(=O)O)C2=CC=CC=C2
Tpsa: 55.12
Logp: 1.7853
H Acceptors: 3
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:
C₁₁H₁₀N₂O₂
Molecular Weight:
202.21
Synonyms:
1-methyl-4-phenyl-1H-imidazol-5-carboxylic acid
SMILES:
CN1C=NC(=C1C(=O)O)C2=CC=CC=C2
Tpsa:
55.12
Logp:
1.7853
H Acceptors:
3
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: C₁₂H₁₄N₂
Molecular Weight: 186.25
Synonyms: 1-Phenyl-3-propyl-pyrazole
SMILES: CCCC1=NN(C=C1)C2=CC=CC=C2
Tpsa: 17.82
Logp: 2.8248
H Acceptors: 2
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:
C₁₂H₁₄N₂
Molecular Weight:
186.25
Synonyms:
1-Phenyl-3-propyl-pyrazole
SMILES:
CCCC1=NN(C=C1)C2=CC=CC=C2
Tpsa:
17.82
Logp:
2.8248
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
3