CS-1000397
Docetaxel Impurity 38
Manufacturer: ChemScene
CAS Number: 1095547-98-0
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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
C₄₆H₅₄Cl₃NO₁₆
Molecular Weight
983.28
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](OC(OCC(Cl)(Cl)Cl)=O)C(=O)[C@]3(C)[C@@H](O)C[C@]1(OC2)[H])=C(C)[C@@H](OC([C@@H]([C@@H](NC(OC(C)(C)C)=O)C6=CC=CC=C6)O)=O)C5)[H]
Tpsa
239.75
Logp
5.7907
H Acceptors
16
H Donors
4
Rotatable Bonds
10
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1095547-98-0 | | A2B Chem | -- |
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: C₄₆H₅₄Cl₃NO₁₆
Molecular Weight: 983.28
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](OC(OCC(Cl)(Cl)Cl)=O)C(=O)[C@]3(C)[C@@H](O)C[C@]1(OC2)[H])=C(C)[C@@H](OC([C@@H]([C@@H](NC(OC(C)(C)C)=O)C6=CC=CC=C6)O)=O)C5)[H]
Tpsa: 239.75
Logp: 5.7907
H Acceptors: 16
H Donors: 4
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:
C₄₆H₅₄Cl₃NO₁₆
Molecular Weight:
983.28
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](OC(OCC(Cl)(Cl)Cl)=O)C(=O)[C@]3(C)[C@@H](O)C[C@]1(OC2)[H])=C(C)[C@@H](OC([C@@H]([C@@H](NC(OC(C)(C)C)=O)C6=CC=CC=C6)O)=O)C5)[H]
Tpsa:
239.75
Logp:
5.7907
H Acceptors:
16
H Donors:
4
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: C₁₈H₂₇NO₂
Molecular Weight: 289.41
Synonyms: None
SMILES: O=C(C=1C=CC=CC1OCCCC)CCN2CCCCC2
Tpsa: 29.54
Logp: 3.9242
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 8
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₂₇NO₂
Molecular Weight:
289.41
Synonyms:
None
SMILES:
O=C(C=1C=CC=CC1OCCCC)CCN2CCCCC2
Tpsa:
29.54
Logp:
3.9242
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₇BrN₂
Molecular Weight: 223.07
Synonyms: None
SMILES: N#CC1=CC(Br)=CC2=C1NCC2
Tpsa: 35.82
Logp: 2.28878
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₇BrN₂
Molecular Weight:
223.07
Synonyms:
None
SMILES:
N#CC1=CC(Br)=CC2=C1NCC2
Tpsa:
35.82
Logp:
2.28878
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₉FN₂O₂
Molecular Weight: 256.23
Synonyms: None
SMILES: O=C1NC2=CC=C(C=C2N1)C(=O)C3=CC=C(F)C=C3
Tpsa: 65.72
Logp: 2.2263
H Acceptors: 2
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:
C₁₄H₉FN₂O₂
Molecular Weight:
256.23
Synonyms:
None
SMILES:
O=C1NC2=CC=C(C=C2N1)C(=O)C3=CC=C(F)C=C3
Tpsa:
65.72
Logp:
2.2263
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
2