CS-1013843
Cetirizine Glycol Impurity
Manufacturer: ChemScene
CAS Number: 324047-29-2
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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
C₂₃H₂₉ClN₂O₄
Molecular Weight
432.94
Synonyms
None
SMILES
O=C(OCCO)COCCN1CCN(CC1)C(C=2C=CC=CC2)C3=CC=C(Cl)C=C3
Tpsa
62.24
Logp
2.5991
H Acceptors
6
H Donors
1
Rotatable Bonds
10
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: C₂₃H₂₉ClN₂O₄
Molecular Weight: 432.94
Synonyms: None
SMILES: O=C(OCCO)COCCN1CCN(CC1)C(C=2C=CC=CC2)C3=CC=C(Cl)C=C3
Tpsa: 62.24
Logp: 2.5991
H Acceptors: 6
H Donors: 1
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:
C₂₃H₂₉ClN₂O₄
Molecular Weight:
432.94
Synonyms:
None
SMILES:
O=C(OCCO)COCCN1CCN(CC1)C(C=2C=CC=CC2)C3=CC=C(Cl)C=C3
Tpsa:
62.24
Logp:
2.5991
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
10
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₄ClNO₅S
Molecular Weight: 367.80
Synonyms: None
SMILES: O=C(OCC)C=1C=CC=CC1C(=O)C2=CC=C(Cl)C(=C2)S(=O)(=O)N
Tpsa: 103.53
Logp: 2.3951
H Acceptors: 5
H Donors: 1
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:
C₁₆H₁₄ClNO₅S
Molecular Weight:
367.80
Synonyms:
None
SMILES:
O=C(OCC)C=1C=CC=CC1C(=O)C2=CC=C(Cl)C(=C2)S(=O)(=O)N
Tpsa:
103.53
Logp:
2.3951
H Acceptors:
5
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: C₂₃H₂₈ClN₃O₂S
Molecular Weight: 446.01
Synonyms: None
SMILES: [C@@H](CC1=CC=CC=C1)(CC[C@@H](CC2=CC=CC=C2)N)NC(OCC3=CN=CS3)=O.Cl
Tpsa: 77.24
Logp: 4.7526
H Acceptors: 5
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:
C₂₃H₂₈ClN₃O₂S
Molecular Weight:
446.01
Synonyms:
None
SMILES:
[C@@H](CC1=CC=CC=C1)(CC[C@@H](CC2=CC=CC=C2)N)NC(OCC3=CN=CS3)=O.Cl
Tpsa:
77.24
Logp:
4.7526
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
10
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₁H₄₁N₅O₄S
Molecular Weight: 579.75
Synonyms: None
SMILES: [C@H](CC1=CC=CC=C1)(CC[C@H](CC2=CC=CC=C2)NC(OCC3=CN=CS3)=O)NC([C@H](CCN4CCOCC4)N)=O
Tpsa: 118.81
Logp: 3.5379
H Acceptors: 8
H Donors: 3
Rotatable Bonds: 15
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₁H₄₁N₅O₄S
Molecular Weight:
579.75
Synonyms:
None
SMILES:
[C@H](CC1=CC=CC=C1)(CC[C@H](CC2=CC=CC=C2)NC(OCC3=CN=CS3)=O)NC([C@H](CCN4CCOCC4)N)=O
Tpsa:
118.81
Logp:
3.5379
H Acceptors:
8
H Donors:
3
Rotatable Bonds:
15