CS-1001594
Isavuconazole Impurity 154
Manufacturer: ChemScene
CAS Number: 150803-12-6
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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
C₁₂H₁₄FN₃O₂
Molecular Weight
251.26
Synonyms
None
SMILES
[C@](CN1C=NC=N1)([C@@H](C)O)(O)C2=C(F)C=CC=C2
Tpsa
71.17
Logp
0.6858
H Acceptors
5
H Donors
2
Rotatable Bonds
4
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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: C₁₂H₁₄FN₃O₂
Molecular Weight: 251.26
Synonyms: None
SMILES: [C@](CN1C=NC=N1)([C@@H](C)O)(O)C2=C(F)C=CC=C2
Tpsa: 71.17
Logp: 0.6858
H Acceptors: 5
H Donors: 2
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:
C₁₂H₁₄FN₃O₂
Molecular Weight:
251.26
Synonyms:
None
SMILES:
[C@](CN1C=NC=N1)([C@@H](C)O)(O)C2=C(F)C=CC=C2
Tpsa:
71.17
Logp:
0.6858
H Acceptors:
5
H Donors:
2
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: C₇H₃Br₂ClO₂
Molecular Weight: 314.36
Synonyms: None
SMILES: O=C(O)C1=CC(Cl)=C(Br)C=C1Br
Tpsa: 37.3
Logp: 3.5632
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₃Br₂ClO₂
Molecular Weight:
314.36
Synonyms:
None
SMILES:
O=C(O)C1=CC(Cl)=C(Br)C=C1Br
Tpsa:
37.3
Logp:
3.5632
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₁₄N₄O₃
Molecular Weight: 334.33
Synonyms: None
SMILES: O=C(O)C1=CC(=O)C(=CN1C2=NC=3C=CC(=CC3N2)N4C=CC=C4)C
Tpsa: 92.91
Logp: 2.51112
H Acceptors: 5
H Donors: 2
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:
C₁₈H₁₄N₄O₃
Molecular Weight:
334.33
Synonyms:
None
SMILES:
O=C(O)C1=CC(=O)C(=CN1C2=NC=3C=CC(=CC3N2)N4C=CC=C4)C
Tpsa:
92.91
Logp:
2.51112
H Acceptors:
5
H Donors:
2
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: C₁₇H₁₃NO₄
Molecular Weight: 295.29
Synonyms: None
SMILES: O=C(OC)C=1N=CC2=CC=C(OC=3C=CC=CC3)C=C2C1O
Tpsa: 68.65
Logp: 3.5193
H Acceptors: 5
H Donors: 1
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:
C₁₇H₁₃NO₄
Molecular Weight:
295.29
Synonyms:
None
SMILES:
O=C(OC)C=1N=CC2=CC=C(OC=3C=CC=CC3)C=C2C1O
Tpsa:
68.65
Logp:
3.5193
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
3