CS-1001124
Posaconazole Impurity 213
Manufacturer: ChemScene
CAS Number: 1350466-83-9
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₆H₁₄N₂O₂
Molecular Weight
146.19
Synonyms
None
SMILES
[C@@H](NNC=O)([C@H](C)O)CC
Tpsa
61.36
Logp
-0.6036
H Acceptors
3
H Donors
3
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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₄N₂O₂
Molecular Weight: 146.19
Synonyms: None
SMILES: [C@@H](NNC=O)([C@H](C)O)CC
Tpsa: 61.36
Logp: -0.6036
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 5
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₄N₂O₂
Molecular Weight:
146.19
Synonyms:
None
SMILES:
[C@@H](NNC=O)([C@H](C)O)CC
Tpsa:
61.36
Logp:
-0.6036
H Acceptors:
3
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: C₆H₁₂NO₅P
Molecular Weight: 209.14
Synonyms: None
SMILES: [C@@H](CCP(=O)O)(NC(C)=O)C(O)=O
Tpsa: 103.7
Logp: -0.5672
H Acceptors: 3
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:
C₆H₁₂NO₅P
Molecular Weight:
209.14
Synonyms:
None
SMILES:
[C@@H](CCP(=O)O)(NC(C)=O)C(O)=O
Tpsa:
103.7
Logp:
-0.5672
H Acceptors:
3
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: C₁₇H₁₂F₄N₄O₂
Molecular Weight: 380.30
Synonyms: None
SMILES: N#CC1=CC=C(C=C1C(F)(F)F)NC(=O)NC2=CC=C(C(=O)NC)C(F)=C2
Tpsa: 94.02
Logp: 3.71978
H Acceptors: 3
H Donors: 3
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:
C₁₇H₁₂F₄N₄O₂
Molecular Weight:
380.30
Synonyms:
None
SMILES:
N#CC1=CC=C(C=C1C(F)(F)F)NC(=O)NC2=CC=C(C(=O)NC)C(F)=C2
Tpsa:
94.02
Logp:
3.71978
H Acceptors:
3
H Donors:
3
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: C₁₆H₁₃F₆N₅O₃
Molecular Weight: 437.30
Synonyms: None
SMILES: O=C(N1CC2=NN=C(N2CC1)C(F)(F)F)CC(N(=O)=O)CC3=CC(F)=C(F)C=C3F
Tpsa: 94.16
Logp: 2.3345
H Acceptors: 6
H Donors: 0
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:
C₁₆H₁₃F₆N₅O₃
Molecular Weight:
437.30
Synonyms:
None
SMILES:
O=C(N1CC2=NN=C(N2CC1)C(F)(F)F)CC(N(=O)=O)CC3=CC(F)=C(F)C=C3F
Tpsa:
94.16
Logp:
2.3345
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
5