CS-1003042
Brivaracetam Impurity 72
Manufacturer: ChemScene
CAS Number: 2399474-27-0
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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
C₁₂H₁₂O₄S
Molecular Weight
252.29
Synonyms
None
SMILES
S(=O)(=O)([C@@]12[C@@](C1)(COC2=O)[H])C3=CC=C(C)C=C3
Tpsa
60.44
Logp
1.08422
H Acceptors
4
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: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂O₄S
Molecular Weight: 252.29
Synonyms: None
SMILES: S(=O)(=O)([C@@]12[C@@](C1)(COC2=O)[H])C3=CC=C(C)C=C3
Tpsa: 60.44
Logp: 1.08422
H Acceptors: 4
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:
C₁₂H₁₂O₄S
Molecular Weight:
252.29
Synonyms:
None
SMILES:
S(=O)(=O)([C@@]12[C@@](C1)(COC2=O)[H])C3=CC=C(C)C=C3
Tpsa:
60.44
Logp:
1.08422
H Acceptors:
4
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: C₁₅H₁₃NO₂
Molecular Weight: 239.27
Synonyms: None
SMILES: O=C(N)CC=1C=CC=C(C1)C(=O)C=2C=CC=CC2
Tpsa: 60.16
Logp: 1.9454
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₃NO₂
Molecular Weight:
239.27
Synonyms:
None
SMILES:
O=C(N)CC=1C=CC=C(C1)C(=O)C=2C=CC=CC2
Tpsa:
60.16
Logp:
1.9454
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
4
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₂₀N₆O₄S
Molecular Weight: 404.44
Synonyms: None
SMILES: O=C(OC)CC1(N2N=CC(=C2)C=3N=CN=C4NC=CC43)CN(C1)S(=O)(=O)CC
Tpsa: 123.07
Logp: 0.7451
H Acceptors: 8
H Donors: 1
Rotatable Bonds: 6
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₀N₆O₄S
Molecular Weight:
404.44
Synonyms:
None
SMILES:
O=C(OC)CC1(N2N=CC(=C2)C=3N=CN=C4NC=CC43)CN(C1)S(=O)(=O)CC
Tpsa:
123.07
Logp:
0.7451
H Acceptors:
8
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₁Cl₃N₆O₃
Molecular Weight: 453.67
Synonyms: None
SMILES: N#CC1=NN(C(=O)NC1=O)C2=CC(Cl)=C(OC3=NN=C(Cl)C(=C3)C(C)C)C(Cl)=C2
Tpsa: 126.55
Logp: 3.45838
H Acceptors: 8
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₁Cl₃N₆O₃
Molecular Weight:
453.67
Synonyms:
None
SMILES:
N#CC1=NN(C(=O)NC1=O)C2=CC(Cl)=C(OC3=NN=C(Cl)C(=C3)C(C)C)C(Cl)=C2
Tpsa:
126.55
Logp:
3.45838
H Acceptors:
8
H Donors:
1
Rotatable Bonds:
4