CS-1004751
Epalrestat Impurity 38
Manufacturer: ChemScene
CAS Number: 76046-54-3
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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
C₆H₈N₂O₄S₄
Molecular Weight
300.40
Synonyms
None
SMILES
O=C(O)CNC(=S)SSC(=S)NCC(=O)O
Tpsa
98.66
Logp
0.286
H Acceptors
6
H Donors
4
Rotatable Bonds
4
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: C₆H₈N₂O₄S₄
Molecular Weight: 300.40
Synonyms: None
SMILES: O=C(O)CNC(=S)SSC(=S)NCC(=O)O
Tpsa: 98.66
Logp: 0.286
H Acceptors: 6
H Donors: 4
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:
C₆H₈N₂O₄S₄
Molecular Weight:
300.40
Synonyms:
None
SMILES:
O=C(O)CNC(=S)SSC(=S)NCC(=O)O
Tpsa:
98.66
Logp:
0.286
H Acceptors:
6
H Donors:
4
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: C₁₃H₇ClFIO
Molecular Weight: 360.55
Synonyms: None
SMILES: O=C(C=1C=CC=CC1F)C2=CC(Cl)=CC=C2I
Tpsa: 17.07
Logp: 4.3147
H Acceptors: 1
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:
C₁₃H₇ClFIO
Molecular Weight:
360.55
Synonyms:
None
SMILES:
O=C(C=1C=CC=CC1F)C2=CC(Cl)=CC=C2I
Tpsa:
17.07
Logp:
4.3147
H Acceptors:
1
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: C₁₆H₂₁NO₂
Molecular Weight: 259.34
Synonyms: None
SMILES: C(OCC1=CC=CC=C1)(=O)[C@H]2C[C@@]3([C@](N2)(CCCC3)[H])[H]
Tpsa: 38.33
Logp: 2.6505
H Acceptors: 3
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:
C₁₆H₂₁NO₂
Molecular Weight:
259.34
Synonyms:
None
SMILES:
C(OCC1=CC=CC=C1)(=O)[C@H]2C[C@@]3([C@](N2)(CCCC3)[H])[H]
Tpsa:
38.33
Logp:
2.6505
H Acceptors:
3
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: C₁₁H₁₄O₃
Molecular Weight: 194.23
Synonyms: None
SMILES: O=C(OC)C(O)(C=1C=CC=CC1)CC
Tpsa: 46.53
Logp: 1.4572
H Acceptors: 3
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:
C₁₁H₁₄O₃
Molecular Weight:
194.23
Synonyms:
None
SMILES:
O=C(OC)C(O)(C=1C=CC=CC1)CC
Tpsa:
46.53
Logp:
1.4572
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3