CS-0144077
7,10-di-Troc-DAB
Manufacturer: ChemScene
CAS Number: 95603-44-4
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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
C₃₅H₃₈Cl₆O₁₄
Molecular Weight
895.39
Synonyms
7,10-Di-O-trichloroethoxycarbonyl-10-deacetyl Baccatin III
SMILES
CC(O[C@]([C@@]1([H])C[C@@H]2OC(OCC(Cl)(Cl)Cl)=O)(CO1)[C@]([C@@H]([C@@](C3(C)C)(C[C@@H]4O)O)OC(C5=CC=CC=C5)=O)([H])[C@@]2(C([C@@H](C3=C4C)OC(OCC(Cl)(Cl)Cl)=O)=O)C)=O
Tpsa
190.42
Logp
6.144
H Acceptors
14
H Donors
2
Rotatable Bonds
7
Other Options
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: C₃₅H₃₈Cl₆O₁₄
Molecular Weight: 895.39
Synonyms: 7,10-Di-O-trichloroethoxycarbonyl-10-deacetyl Baccatin III
SMILES: CC(O[C@]([C@@]1([H])C[C@@H]2OC(OCC(Cl)(Cl)Cl)=O)(CO1)[C@]([C@@H]([C@@](C3(C)C)(C[C@@H]4O)O)OC(C5=CC=CC=C5)=O)([H])[C@@]2(C([C@@H](C3=C4C)OC(OCC(Cl)(Cl)Cl)=O)=O)C)=O
Tpsa: 190.42
Logp: 6.144
H Acceptors: 14
H Donors: 2
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₅H₃₈Cl₆O₁₄
Molecular Weight:
895.39
Synonyms:
7,10-Di-O-trichloroethoxycarbonyl-10-deacetyl Baccatin III
SMILES:
CC(O[C@]([C@@]1([H])C[C@@H]2OC(OCC(Cl)(Cl)Cl)=O)(CO1)[C@]([C@@H]([C@@](C3(C)C)(C[C@@H]4O)O)OC(C5=CC=CC=C5)=O)([H])[C@@]2(C([C@@H](C3=C4C)OC(OCC(Cl)(Cl)Cl)=O)=O)C)=O
Tpsa:
190.42
Logp:
6.144
H Acceptors:
14
H Donors:
2
Rotatable Bonds:
7
Purity: 98%
MDL No: MFCD08062410
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₇H₆₈N₂O₁₃
Molecular Weight: 748.94
Synonyms: Erythromycin A oxime; Erythromycin-9-oxime
SMILES: C[C@H]([C@H]([C@](O)(C[C@H](/C([C@@H]([C@H]([C@](O)([C@H](OC([C@@H]1C)=O)CC)C)O)C)=N/O)C)C)O[C@H]2[C@@H]([C@H](C[C@H](O2)C)N(C)C)O)[C@@H]1O[C@H]3C[C@](C)([C@H]([C@@H](O3)C)O)OC
Tpsa: 209.43
Logp: 2.0467
H Acceptors: 15
H Donors: 6
Rotatable Bonds: 7
Purity:
98%
MDL No:
MFCD08062410
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₇H₆₈N₂O₁₃
Molecular Weight:
748.94
Synonyms:
Erythromycin A oxime; Erythromycin-9-oxime
SMILES:
C[C@H]([C@H]([C@](O)(C[C@H](/C([C@@H]([C@H]([C@](O)([C@H](OC([C@@H]1C)=O)CC)C)O)C)=N/O)C)C)O[C@H]2[C@@H]([C@H](C[C@H](O2)C)N(C)C)O)[C@@H]1O[C@H]3C[C@](C)([C@H]([C@@H](O3)C)O)OC
Tpsa:
209.43
Logp:
2.0467
H Acceptors:
15
H Donors:
6
Rotatable Bonds:
7
Purity: 98+%
MDL No: MFCD18255029
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₅ClINO
Molecular Weight: 269.47
Synonyms: None
SMILES: COC1=CC=C(Cl)N=C1I
Tpsa: 22.12
Logp: 2.3482
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
98+%
MDL No:
MFCD18255029
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₅ClINO
Molecular Weight:
269.47
Synonyms:
None
SMILES:
COC1=CC=C(Cl)N=C1I
Tpsa:
22.12
Logp:
2.3482
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD00036667
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₆O₄
Molecular Weight: 224.25
Synonyms: Phenol, 2-ethoxy-4-(4-methyl-1,3-dioxolan-2-yl)-
SMILES: OC1=CC=C(C2OCC(C)O2)C=C1OCC
Tpsa: 47.92
Logp: 2.2248
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD00036667
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₆O₄
Molecular Weight:
224.25
Synonyms:
Phenol, 2-ethoxy-4-(4-methyl-1,3-dioxolan-2-yl)-
SMILES:
OC1=CC=C(C2OCC(C)O2)C=C1OCC
Tpsa:
47.92
Logp:
2.2248
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3