CS-1002727
Rivaroxaban Impurity 174
Manufacturer: ChemScene
CAS Number: 2197189-55-0
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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
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
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: 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
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₀O₃
Molecular Weight: 130.14
Synonyms: None
SMILES: O(C(C)=O)[C@H]1CCOC1
Tpsa: 35.53
Logp: 0.3384
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:
C₆H₁₀O₃
Molecular Weight:
130.14
Synonyms:
None
SMILES:
O(C(C)=O)[C@H]1CCOC1
Tpsa:
35.53
Logp:
0.3384
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₆N₂
Molecular Weight: 246.39
Synonyms: None
SMILES: [C@H](CC(C)C)(N)C1=C(C=CC=C1)N2CCCCC2
Tpsa: 29.26
Logp: 3.7228
H Acceptors: 2
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:
C₁₆H₂₆N₂
Molecular Weight:
246.39
Synonyms:
None
SMILES:
[C@H](CC(C)C)(N)C1=C(C=CC=C1)N2CCCCC2
Tpsa:
29.26
Logp:
3.7228
H Acceptors:
2
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: C₁₈H₂₂N₄O₂
Molecular Weight: 326.39
Synonyms: None
SMILES: O=C(N)NC1=CC=C(C=C1)N2CCN(C3=CC=C(OC)C=C3)CC2
Tpsa: 70.83
Logp: 2.5124
H Acceptors: 4
H Donors: 2
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:
C₁₈H₂₂N₄O₂
Molecular Weight:
326.39
Synonyms:
None
SMILES:
O=C(N)NC1=CC=C(C=C1)N2CCN(C3=CC=C(OC)C=C3)CC2
Tpsa:
70.83
Logp:
2.5124
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
4