CS-0914638
Bromocriptine Impurity 3
Manufacturer: ChemScene
CAS Number: 82796-58-5
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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
C₃₂H₄₀BrN₅O₅
Molecular Weight
654.59
Synonyms
None
SMILES
O[C@]12N(C(=O)[C@](NC(=O)[C@H]3C=C4C=5C=6C(C[C@]4(N(C)C3)[H])=C(Br)NC6C=CC5)([C@H](C)C)O1)[C@@H](CC(C)C)C(=O)N7[C@]2(CCC7)[H]
Tpsa
118.21
Logp
3.1928
H Acceptors
6
H Donors
3
Rotatable Bonds
5
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 82796-58-5 | | A2B Chem | -- |
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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: C₃₂H₄₀BrN₅O₅
Molecular Weight: 654.59
Synonyms: None
SMILES: O[C@]12N(C(=O)[C@](NC(=O)[C@H]3C=C4C=5C=6C(C[C@]4(N(C)C3)[H])=C(Br)NC6C=CC5)([C@H](C)C)O1)[C@@H](CC(C)C)C(=O)N7[C@]2(CCC7)[H]
Tpsa: 118.21
Logp: 3.1928
H Acceptors: 6
H Donors: 3
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:
C₃₂H₄₀BrN₅O₅
Molecular Weight:
654.59
Synonyms:
None
SMILES:
O[C@]12N(C(=O)[C@](NC(=O)[C@H]3C=C4C=5C=6C(C[C@]4(N(C)C3)[H])=C(Br)NC6C=CC5)([C@H](C)C)O1)[C@@H](CC(C)C)C(=O)N7[C@]2(CCC7)[H]
Tpsa:
118.21
Logp:
3.1928
H Acceptors:
6
H Donors:
3
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: C₂₁H₂₈O₅
Molecular Weight: 360.44
Synonyms: None
SMILES: C[C@@]12[C@]([C@]3([C@@]([C@]4(C)C(CC3)=CC(=O)C=C4)([C@@H](O)C1)[H])[H])(C[C@@H](O)[C@@H]2C(CO)=O)[H]
Tpsa: 94.83
Logp: 1.4135
H Acceptors: 5
H Donors: 3
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:
C₂₁H₂₈O₅
Molecular Weight:
360.44
Synonyms:
None
SMILES:
C[C@@]12[C@]([C@]3([C@@]([C@]4(C)C(CC3)=CC(=O)C=C4)([C@@H](O)C1)[H])[H])(C[C@@H](O)[C@@H]2C(CO)=O)[H]
Tpsa:
94.83
Logp:
1.4135
H Acceptors:
5
H Donors:
3
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: C₂₅H₃₀O₇
Molecular Weight: 442.50
Synonyms: None
SMILES: C(COC(C)=O)(=O)[C@]1(O)[C@]2(C)[C@@](C[C@H]1OC(C)=O)([C@]3(C(=CC2)[C@]4(C)C(CC3)=CC(=O)C=C4)[H])[H]
Tpsa: 106.97
Logp: 2.6193
H Acceptors: 7
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:
C₂₅H₃₀O₇
Molecular Weight:
442.50
Synonyms:
None
SMILES:
C(COC(C)=O)(=O)[C@]1(O)[C@]2(C)[C@@](C[C@H]1OC(C)=O)([C@]3(C(=CC2)[C@]4(C)C(CC3)=CC(=O)C=C4)[H])[H]
Tpsa:
106.97
Logp:
2.6193
H Acceptors:
7
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: C₁₂H₂₄O₃
Molecular Weight: 216.32
Synonyms: None
SMILES: O1C(OC(OC1CCC)CCC)CCC
Tpsa: 27.69
Logp: 3.4284
H Acceptors: 3
H Donors: 0
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:
C₁₂H₂₄O₃
Molecular Weight:
216.32
Synonyms:
None
SMILES:
O1C(OC(OC1CCC)CCC)CCC
Tpsa:
27.69
Logp:
3.4284
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
6