CS-0746506
1-(4-Methylphenyl)sulfonyl-2,3,4,6-tetrahydro-1-benzazocin-5-one
Manufacturer: ChemScene
CAS Number: 88239-75-2
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Purity
98%
MDL No
MFCD22200199
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₈H₁₉NO₃S
Molecular Weight
329.41
Synonyms
None
SMILES
CC1=CC=C(C=C1)S(=O)(=O)N1CCCC(=O)CC2=C1C=CC=C2
Tpsa
54.45
Logp
3.09572
H Acceptors
3
H Donors
0
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: MFCD22200199
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₁₉NO₃S
Molecular Weight: 329.41
Synonyms: None
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N1CCCC(=O)CC2=C1C=CC=C2
Tpsa: 54.45
Logp: 3.09572
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD22200199
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₉NO₃S
Molecular Weight:
329.41
Synonyms:
None
SMILES:
CC1=CC=C(C=C1)S(=O)(=O)N1CCCC(=O)CC2=C1C=CC=C2
Tpsa:
54.45
Logp:
3.09572
H Acceptors:
3
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: C₁₆H₂₁NO₆
Molecular Weight: 323.34
Synonyms: None
SMILES: CC(C)(C)OC(=O)C1=CC(=CC(=C1)C(=O)OC(C)(C)C)[N+]([O-])=O
Tpsa: 95.74
Logp: 3.5054
H Acceptors: 6
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:
C₁₆H₂₁NO₆
Molecular Weight:
323.34
Synonyms:
None
SMILES:
CC(C)(C)OC(=O)C1=CC(=CC(=C1)C(=O)OC(C)(C)C)[N+]([O-])=O
Tpsa:
95.74
Logp:
3.5054
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: MFCD11038564
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂F₃N₃
Molecular Weight: 255.24
Synonyms: None
SMILES: FC(F)(F)C1=CC(=CC=C1N1CCNCC1)C#N
Tpsa: 39.06
Logp: 1.98668
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD11038564
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₂F₃N₃
Molecular Weight:
255.24
Synonyms:
None
SMILES:
FC(F)(F)C1=CC(=CC=C1N1CCNCC1)C#N
Tpsa:
39.06
Logp:
1.98668
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD27922667
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₄ClN₃O₂
Molecular Weight: 325.83
Synonyms: None
SMILES: CC(C)(C)OC(=O)N1CCC(CC1)NC1=CC=C(Cl)C=C1N
Tpsa: 67.59
Logp: 3.7336
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD27922667
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₄ClN₃O₂
Molecular Weight:
325.83
Synonyms:
None
SMILES:
CC(C)(C)OC(=O)N1CCC(CC1)NC1=CC=C(Cl)C=C1N
Tpsa:
67.59
Logp:
3.7336
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
2