CS-1003799
Isosorbide Impurity 13
Manufacturer: ChemScene
CAS Number: 39698-15-2
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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
C₈H₁₁NO₇
Molecular Weight
233.18
Synonyms
None
SMILES
O(C(C)=O)[C@H]1[C@@]2([C@@]([C@@H](ON(=O)=O)CO2)(OC1)[H])[H]
Tpsa
97.13
Logp
-0.7074
H Acceptors
7
H Donors
0
Rotatable Bonds
3
Related Products
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: C₈H₁₁NO₇
Molecular Weight: 233.18
Synonyms: None
SMILES: O(C(C)=O)[C@H]1[C@@]2([C@@]([C@@H](ON(=O)=O)CO2)(OC1)[H])[H]
Tpsa: 97.13
Logp: -0.7074
H Acceptors: 7
H Donors: 0
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:
C₈H₁₁NO₇
Molecular Weight:
233.18
Synonyms:
None
SMILES:
O(C(C)=O)[C@H]1[C@@]2([C@@]([C@@H](ON(=O)=O)CO2)(OC1)[H])[H]
Tpsa:
97.13
Logp:
-0.7074
H Acceptors:
7
H Donors:
0
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: C₇H₁₂O₄
Molecular Weight: 160.17
Synonyms: None
SMILES: [C@H](CC(O)=O)(CCC)C(O)=O
Tpsa: 74.6
Logp: 0.962
H Acceptors: 2
H Donors: 2
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:
C₇H₁₂O₄
Molecular Weight:
160.17
Synonyms:
None
SMILES:
[C@H](CC(O)=O)(CCC)C(O)=O
Tpsa:
74.6
Logp:
0.962
H Acceptors:
2
H Donors:
2
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: C₃₁H₃₀F₂O₈S
Molecular Weight: 600.63
Synonyms: None
SMILES: O(C(=O)C1=CC=CO1)[C@@]2(C(SC(=O)C3=CC=CO3)=O)[C@]4(C)[C@@](C[C@H]2C)([C@]5([C@](F)([C@@H](O)C4)[C@]6(C)C([C@@H](F)C5)=CC(=O)C=C6)[H])[H]
Tpsa: 124.02
Logp: 5.4332
H Acceptors: 9
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:
C₃₁H₃₀F₂O₈S
Molecular Weight:
600.63
Synonyms:
None
SMILES:
O(C(=O)C1=CC=CO1)[C@@]2(C(SC(=O)C3=CC=CO3)=O)[C@]4(C)[C@@](C[C@H]2C)([C@]5([C@](F)([C@@H](O)C4)[C@]6(C)C([C@@H](F)C5)=CC(=O)C=C6)[H])[H]
Tpsa:
124.02
Logp:
5.4332
H Acceptors:
9
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: C₁₁H₁₄O₃
Molecular Weight: 194.23
Synonyms: None
SMILES: O=C(OCC)C(C=1C=CC=CC1)CO
Tpsa: 46.53
Logp: 1.3256
H Acceptors: 3
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:
C₁₁H₁₄O₃
Molecular Weight:
194.23
Synonyms:
None
SMILES:
O=C(OCC)C(C=1C=CC=CC1)CO
Tpsa:
46.53
Logp:
1.3256
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
4