CS-1002724
Shikimic Acid Impurity 4
Manufacturer: ChemScene
CAS Number: 21967-35-1
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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
C₇H₁₀O₅
Molecular Weight
174.15
Synonyms
None
SMILES
C(O)(=O)C=1C[C@@H](O)[C@@H](O)[C@H](O)C1
Tpsa
97.99
Logp
-1.5162
H Acceptors
4
H Donors
4
Rotatable Bonds
1
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: C₇H₁₀O₅
Molecular Weight: 174.15
Synonyms: None
SMILES: C(O)(=O)C=1C[C@@H](O)[C@@H](O)[C@H](O)C1
Tpsa: 97.99
Logp: -1.5162
H Acceptors: 4
H Donors: 4
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:
C₇H₁₀O₅
Molecular Weight:
174.15
Synonyms:
None
SMILES:
C(O)(=O)C=1C[C@@H](O)[C@@H](O)[C@H](O)C1
Tpsa:
97.99
Logp:
-1.5162
H Acceptors:
4
H Donors:
4
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: C₁₃H₁₁ClF₂N₂O
Molecular Weight: 284.69
Synonyms: None
SMILES: FC(F)(C1=NC(Cl)=CC(=N1)OCC=2C=CC=CC2)C
Tpsa: 35.01
Logp: 3.8207
H Acceptors: 3
H Donors: 0
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:
C₁₃H₁₁ClF₂N₂O
Molecular Weight:
284.69
Synonyms:
None
SMILES:
FC(F)(C1=NC(Cl)=CC(=N1)OCC=2C=CC=CC2)C
Tpsa:
35.01
Logp:
3.8207
H Acceptors:
3
H Donors:
0
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: C₁₉H₁₈ClN₃O₆S
Molecular Weight: 451.88
Synonyms: None
SMILES: O=C1N(C[C@H](CNC(=O)C=2S(=O)C(Cl)=CC2)O1)C3=CC=C(C=C3)N4C(=O)COCC4
Tpsa: 105.25
Logp: 1.2176
H Acceptors: 6
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:
C₁₉H₁₈ClN₃O₆S
Molecular Weight:
451.88
Synonyms:
None
SMILES:
O=C1N(C[C@H](CNC(=O)C=2S(=O)C(Cl)=CC2)O1)C3=CC=C(C=C3)N4C(=O)COCC4
Tpsa:
105.25
Logp:
1.2176
H Acceptors:
6
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: C₃₆H₃₆N₆O₁₀
Molecular Weight: 712.71
Synonyms: None
SMILES: O=C1N(C[C@H](CNC(=O)C2=C(C(NCC3CN(C(=O)O3)C4=CC=C(C=C4)N5C(=O)COCC5)=O)C=CC=C2)O1)C6=CC=C(C=C6)N7C(=O)COCC7
Tpsa: 176.36
Logp: 1.9234
H Acceptors: 10
H Donors: 2
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₆H₃₆N₆O₁₀
Molecular Weight:
712.71
Synonyms:
None
SMILES:
O=C1N(C[C@H](CNC(=O)C2=C(C(NCC3CN(C(=O)O3)C4=CC=C(C=C4)N5C(=O)COCC5)=O)C=CC=C2)O1)C6=CC=C(C=C6)N7C(=O)COCC7
Tpsa:
176.36
Logp:
1.9234
H Acceptors:
10
H Donors:
2
Rotatable Bonds:
10