CS-1005395
Brivaracetam Impurity 87
Manufacturer: ChemScene
CAS Number: 943986-66-1
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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
C₁₁H₁₉NO₃
Molecular Weight
213.27
Synonyms
None
SMILES
[C@@H](C(O)=O)(CC)N1CC(CCC)CC1=O
Tpsa
57.61
Logp
1.4982
H Acceptors
2
H Donors
1
Rotatable Bonds
5
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₁₁H₁₉NO₃
Molecular Weight: 213.27
Synonyms: None
SMILES: [C@@H](C(O)=O)(CC)N1CC(CCC)CC1=O
Tpsa: 57.61
Logp: 1.4982
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:
C₁₁H₁₉NO₃
Molecular Weight:
213.27
Synonyms:
None
SMILES:
[C@@H](C(O)=O)(CC)N1CC(CCC)CC1=O
Tpsa:
57.61
Logp:
1.4982
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: C₄₃H₆₃N₃O₁₄
Molecular Weight: 845.97
Synonyms: None
SMILES: O(C[C@H](CN(C[C@@H](COC1=CC=C(CCC(OC[C@@H]2COC(C)(C)O2)=O)C=C1)O)CCNC(=O)N3CCOCC3)O)C4=CC=C(CCC(OC[C@@H]5COC(C)(C)O5)=O)C=C4
Tpsa: 193.25
Logp: 2.4646
H Acceptors: 15
H Donors: 3
Rotatable Bonds: 23
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₃H₆₃N₃O₁₄
Molecular Weight:
845.97
Synonyms:
None
SMILES:
O(C[C@H](CN(C[C@@H](COC1=CC=C(CCC(OC[C@@H]2COC(C)(C)O2)=O)C=C1)O)CCNC(=O)N3CCOCC3)O)C4=CC=C(CCC(OC[C@@H]5COC(C)(C)O5)=O)C=C4
Tpsa:
193.25
Logp:
2.4646
H Acceptors:
15
H Donors:
3
Rotatable Bonds:
23
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₂₄N₂O₂
Molecular Weight: 312.41
Synonyms: None
SMILES: O=C1N(C=CN(C(=O)C2CCCCC2)C1)CCC=3C=CC=CC3
Tpsa: 40.62
Logp: 2.9514
H Acceptors: 2
H Donors: 0
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:
C₁₉H₂₄N₂O₂
Molecular Weight:
312.41
Synonyms:
None
SMILES:
O=C1N(C=CN(C(=O)C2CCCCC2)C1)CCC=3C=CC=CC3
Tpsa:
40.62
Logp:
2.9514
H Acceptors:
2
H Donors:
0
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: C₁₅H₁₉NO₂
Molecular Weight: 245.32
Synonyms: None
SMILES: C(OCC1=CC=CC=C1)(=O)[C@H]2C[C@]3([C@@](N2)(CCC3)[H])[H]
Tpsa: 38.33
Logp: 2.2604
H Acceptors: 3
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:
C₁₅H₁₉NO₂
Molecular Weight:
245.32
Synonyms:
None
SMILES:
C(OCC1=CC=CC=C1)(=O)[C@H]2C[C@]3([C@@](N2)(CCC3)[H])[H]
Tpsa:
38.33
Logp:
2.2604
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3