CS-1001144
Posaconazole Impurity 46
Manufacturer: ChemScene
CAS Number: 1356330-68-1
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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
C₁₂H₁₉NO
Molecular Weight
193.29
Synonyms
None
SMILES
C(O[C@H]([C@H](CC)N)C)C1=CC=CC=C1
Tpsa
35.25
Logp
2.329
H Acceptors
2
H Donors
1
Rotatable Bonds
5
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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: C₁₂H₁₉NO
Molecular Weight: 193.29
Synonyms: None
SMILES: C(O[C@H]([C@H](CC)N)C)C1=CC=CC=C1
Tpsa: 35.25
Logp: 2.329
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:
C₁₂H₁₉NO
Molecular Weight:
193.29
Synonyms:
None
SMILES:
C(O[C@H]([C@H](CC)N)C)C1=CC=CC=C1
Tpsa:
35.25
Logp:
2.329
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: C₄₃H₆₇NO₁₂
Molecular Weight: 789.99
Synonyms: None
SMILES: O=C1C(=O)C2(O)OC(C(OC)CC(C)CC(=CC(C(=O)CC(O)C(C)C(OC(=O)C3N1CCCC3)C(=CC4CCC(O)C(O)C4)C)CC=C)C)C(OC)CC2C
Tpsa: 189.36
Logp: 3.9849
H Acceptors: 12
H Donors: 4
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:
C₄₃H₆₇NO₁₂
Molecular Weight:
789.99
Synonyms:
None
SMILES:
O=C1C(=O)C2(O)OC(C(OC)CC(C)CC(=CC(C(=O)CC(O)C(C)C(OC(=O)C3N1CCCC3)C(=CC4CCC(O)C(O)C4)C)CC=C)C)C(OC)CC2C
Tpsa:
189.36
Logp:
3.9849
H Acceptors:
12
H Donors:
4
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: C₄₄H₆₉NO₁₁
Molecular Weight: 788.02
Synonyms: None
SMILES: O=C1OC(C(=CC2CCC(O)C(OC)C2)C)C(C)CCC(=O)C(C=C(C)CC(C)CC(OC)C3OC(O)(C(=O)C(=O)N4CCCCC14)C(C)CC3OC)CC=C
Tpsa: 158.13
Logp: 5.6682
H Acceptors: 11
H Donors: 2
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₄H₆₉NO₁₁
Molecular Weight:
788.02
Synonyms:
None
SMILES:
O=C1OC(C(=CC2CCC(O)C(OC)C2)C)C(C)CCC(=O)C(C=C(C)CC(C)CC(OC)C3OC(O)(C(=O)C(=O)N4CCCCC14)C(C)CC3OC)CC=C
Tpsa:
158.13
Logp:
5.6682
H Acceptors:
11
H Donors:
2
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₆O₃
Molecular Weight: 232.28
Synonyms: None
SMILES: C(C(OC)=O)[C@H]1C=2C3=C(C=CC2CC1)OCC3
Tpsa: 35.53
Logp: 2.2144
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:
C₁₄H₁₆O₃
Molecular Weight:
232.28
Synonyms:
None
SMILES:
C(C(OC)=O)[C@H]1C=2C3=C(C=CC2CC1)OCC3
Tpsa:
35.53
Logp:
2.2144
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2