CS-1001911
Rupatadine Impurity 25
Manufacturer: ChemScene
CAS Number: 165740-07-8
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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
C₂₆H₂₃ClN₂O₂
Molecular Weight
430.93
Synonyms
None
SMILES
O=C(OC=1C=CC=CC1)N2CCC(=C3C=4N=CC=CC4CCC=5C=C(Cl)C=CC53)CC2
Tpsa
42.43
Logp
5.9303
H Acceptors
3
H Donors
0
Rotatable Bonds
1
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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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₆H₂₃ClN₂O₂
Molecular Weight: 430.93
Synonyms: None
SMILES: O=C(OC=1C=CC=CC1)N2CCC(=C3C=4N=CC=CC4CCC=5C=C(Cl)C=CC53)CC2
Tpsa: 42.43
Logp: 5.9303
H Acceptors: 3
H Donors: 0
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:
C₂₆H₂₃ClN₂O₂
Molecular Weight:
430.93
Synonyms:
None
SMILES:
O=C(OC=1C=CC=CC1)N2CCC(=C3C=4N=CC=CC4CCC=5C=C(Cl)C=CC53)CC2
Tpsa:
42.43
Logp:
5.9303
H Acceptors:
3
H Donors:
0
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: C₂₂H₂₆FN₃NaO₅S
Molecular Weight: 486.51
Synonyms: None
SMILES: C(=C/[C@@H](C/C=C\C(O)=O)O)\C=1C(=NC(N(S(C)(=O)=O)C)=NC1C(C)C)C2=CC=C(F)C=C2.[Na]
Tpsa: 120.69
Logp: 2.8261
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₂₆FN₃NaO₅S
Molecular Weight:
486.51
Synonyms:
None
SMILES:
C(=C/[C@@H](C/C=C\C(O)=O)O)\C=1C(=NC(N(S(C)(=O)=O)C)=NC1C(C)C)C2=CC=C(F)C=C2.[Na]
Tpsa:
120.69
Logp:
2.8261
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₂₆FN₃O₅S
Molecular Weight: 463.52
Synonyms: None
SMILES: C(=C/[C@@H](C/C=C\C(O)=O)O)\C=1C(=NC(N(S(C)(=O)=O)C)=NC1C(C)C)C2=CC=C(F)C=C2
Tpsa: 120.69
Logp: 3.2069
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₂₆FN₃O₅S
Molecular Weight:
463.52
Synonyms:
None
SMILES:
C(=C/[C@@H](C/C=C\C(O)=O)O)\C=1C(=NC(N(S(C)(=O)=O)C)=NC1C(C)C)C2=CC=C(F)C=C2
Tpsa:
120.69
Logp:
3.2069
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
9
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₃₁NO₇
Molecular Weight: 445.51
Synonyms: None
SMILES: O=C(O)CCC(=O)OC(COC=1C=CC=CC1C(O)CC=2C=CC=C(OC)C2)CN(C)C
Tpsa: 105.53
Logp: 2.6883
H Acceptors: 7
H Donors: 2
Rotatable Bonds: 13
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₃₁NO₇
Molecular Weight:
445.51
Synonyms:
None
SMILES:
O=C(O)CCC(=O)OC(COC=1C=CC=CC1C(O)CC=2C=CC=C(OC)C2)CN(C)C
Tpsa:
105.53
Logp:
2.6883
H Acceptors:
7
H Donors:
2
Rotatable Bonds:
13