CS-1000422
Isosorbide Impurity 21
Manufacturer: ChemScene
CAS Number: 110627-23-1
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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
C₆H₇NO₆
Molecular Weight
189.12
Synonyms
None
SMILES
O(N(=O)=O)[C@@H]1[C@@]2([C@@](C(=O)CO2)(OC1)[H])[H]
Tpsa
87.9
Logp
-1.07
H Acceptors
6
H Donors
0
Rotatable Bonds
2
SAFETY INFORMATION
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: C₆H₇NO₆
Molecular Weight: 189.12
Synonyms: None
SMILES: O(N(=O)=O)[C@@H]1[C@@]2([C@@](C(=O)CO2)(OC1)[H])[H]
Tpsa: 87.9
Logp: -1.07
H Acceptors: 6
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:
C₆H₇NO₆
Molecular Weight:
189.12
Synonyms:
None
SMILES:
O(N(=O)=O)[C@@H]1[C@@]2([C@@](C(=O)CO2)(OC1)[H])[H]
Tpsa:
87.9
Logp:
-1.07
H Acceptors:
6
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: C₂₂H₂₈O₃
Molecular Weight: 340.46
Synonyms: None
SMILES: C[C@@]12[C@]([C@]3(C([C@]4(C)C([C@@H](C)C3)=CC(=O)C=C4)=CC1)[H])(CC[C@@]2(C(C)=O)O)[H]
Tpsa: 54.37
Logp: 3.7805
H Acceptors: 3
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:
C₂₂H₂₈O₃
Molecular Weight:
340.46
Synonyms:
None
SMILES:
C[C@@]12[C@]([C@]3(C([C@]4(C)C([C@@H](C)C3)=CC(=O)C=C4)=CC1)[H])(CC[C@@]2(C(C)=O)O)[H]
Tpsa:
54.37
Logp:
3.7805
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₁₉N₃O₅S
Molecular Weight: 389.43
Synonyms: None
SMILES: C(O)(=O)C=1N2[C@@]([C@H](NC([C@@H](N)C3=CC=C(O)C=C3)=O)C2=O)(SCC1/C=C\C)[H]
Tpsa: 132.96
Logp: 0.7067
H Acceptors: 6
H Donors: 4
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:
C₁₈H₁₉N₃O₅S
Molecular Weight:
389.43
Synonyms:
None
SMILES:
C(O)(=O)C=1N2[C@@]([C@H](NC([C@@H](N)C3=CC=C(O)C=C3)=O)C2=O)(SCC1/C=C\C)[H]
Tpsa:
132.96
Logp:
0.7067
H Acceptors:
6
H Donors:
4
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: C₁₂H₁₀FNO₂
Molecular Weight: 219.21
Synonyms: None
SMILES: O=C1C=CC(=CN1C=2C=CC=C(F)C2)CO
Tpsa: 42.23
Logp: 1.4689
H Acceptors: 3
H Donors: 1
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:
C₁₂H₁₀FNO₂
Molecular Weight:
219.21
Synonyms:
None
SMILES:
O=C1C=CC(=CN1C=2C=CC=C(F)C2)CO
Tpsa:
42.23
Logp:
1.4689
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2