CS-1005341
Docetaxel Impurity 61
Manufacturer: ChemScene
CAS Number: 92999-93-4
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Purity
≥95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₉H₃₆O₁₀
Molecular Weight
544.59
Synonyms
None
SMILES
O(C(C)=O)[C@]12[C@]3([C@H](OC(=O)C4=CC=CC=C4)[C@@]5(O)C(C)(C)C([C@@H](O)C(=O)[C@@]3(C)[C@@H](O)C[C@]1(OC2)[H])=C(C)[C@@H](O)C5)[H]
Tpsa
159.82
Logp
1.0818
H Acceptors
10
H Donors
4
Rotatable Bonds
3
Other Options
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: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₉H₃₆O₁₀
Molecular Weight: 544.59
Synonyms: None
SMILES: O(C(C)=O)[C@]12[C@]3([C@H](OC(=O)C4=CC=CC=C4)[C@@]5(O)C(C)(C)C([C@@H](O)C(=O)[C@@]3(C)[C@@H](O)C[C@]1(OC2)[H])=C(C)[C@@H](O)C5)[H]
Tpsa: 159.82
Logp: 1.0818
H Acceptors: 10
H Donors: 4
Rotatable Bonds: 3
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₉H₃₆O₁₀
Molecular Weight:
544.59
Synonyms:
None
SMILES:
O(C(C)=O)[C@]12[C@]3([C@H](OC(=O)C4=CC=CC=C4)[C@@]5(O)C(C)(C)C([C@@H](O)C(=O)[C@@]3(C)[C@@H](O)C[C@]1(OC2)[H])=C(C)[C@@H](O)C5)[H]
Tpsa:
159.82
Logp:
1.0818
H Acceptors:
10
H Donors:
4
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: C₁₂H₂₁NO₃
Molecular Weight: 227.30
Synonyms: None
SMILES: C(C(OC)=O)(CC)N1C[C@H](CCC)CC1=O
Tpsa: 46.61
Logp: 1.5866
H Acceptors: 3
H Donors: 0
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:
C₁₂H₂₁NO₃
Molecular Weight:
227.30
Synonyms:
None
SMILES:
C(C(OC)=O)(CC)N1C[C@H](CCC)CC1=O
Tpsa:
46.61
Logp:
1.5866
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
5
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₀FN₃O₃
Molecular Weight: 345.37
Synonyms: None
SMILES: O=C(O)C1=CN(C2=CC(=C(F)C=C2C1=O)N3CCNC(C)C3)C4CC4
Tpsa: 74.57
Logp: 1.9718
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₀FN₃O₃
Molecular Weight:
345.37
Synonyms:
None
SMILES:
O=C(O)C1=CN(C2=CC(=C(F)C=C2C1=O)N3CCNC(C)C3)C4CC4
Tpsa:
74.57
Logp:
1.9718
H Acceptors:
5
H Donors:
2
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: C₁₁H₁₁NO₄
Molecular Weight: 221.21
Synonyms: None
SMILES: O=C(O)C1=CC=C(NC(=O)C)C2=C1OCC2
Tpsa: 75.63
Logp: 1.2781
H Acceptors: 3
H Donors: 2
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:
C₁₁H₁₁NO₄
Molecular Weight:
221.21
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(NC(=O)C)C2=C1OCC2
Tpsa:
75.63
Logp:
1.2781
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
2