CS-1000624
Pregna-1,4,17(20)-trien-21-al, 11,20-dihydroxy-3-oxo-, (11β,17E)-
Manufacturer: ChemScene
CAS Number: 118864-88-3
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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
C₂₁H₂₆O₄
Molecular Weight
342.43
Synonyms
None
SMILES
C[C@@]12[C@@]3([C@]([C@]4([C@](C)(C[C@@H]3O)/C(=C(\C=O)/O)/CC4)[H])(CCC1=CC(=O)C=C2)[H])[H]
Tpsa
74.6
Logp
3.2761
H Acceptors
4
H Donors
2
Rotatable Bonds
1
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 118864-88-3 | | A2B Chem | -- |
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: C₂₁H₂₆O₄
Molecular Weight: 342.43
Synonyms: None
SMILES: C[C@@]12[C@@]3([C@]([C@]4([C@](C)(C[C@@H]3O)/C(=C(\C=O)/O)/CC4)[H])(CCC1=CC(=O)C=C2)[H])[H]
Tpsa: 74.6
Logp: 3.2761
H Acceptors: 4
H Donors: 2
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:
C₂₁H₂₆O₄
Molecular Weight:
342.43
Synonyms:
None
SMILES:
C[C@@]12[C@@]3([C@]([C@]4([C@](C)(C[C@@H]3O)/C(=C(\C=O)/O)/CC4)[H])(CCC1=CC(=O)C=C2)[H])[H]
Tpsa:
74.6
Logp:
3.2761
H Acceptors:
4
H Donors:
2
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: C₈H₇ClO₃
Molecular Weight: 186.59
Synonyms: None
SMILES: O=C(C=1C=CC=CC1Cl)C(O)O
Tpsa: 57.53
Logp: 0.8334
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₇ClO₃
Molecular Weight:
186.59
Synonyms:
None
SMILES:
O=C(C=1C=CC=CC1Cl)C(O)O
Tpsa:
57.53
Logp:
0.8334
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: C₁₅H₁₀N₄O₆
Molecular Weight: 342.26
Synonyms: None
SMILES: O=C1NC(=O)C(N1)(C2=CC=C(C=C2)N(=O)=O)C3=CC=C(C=C3)N(=O)=O
Tpsa: 144.48
Logp: 1.586
H Acceptors: 6
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:
C₁₅H₁₀N₄O₆
Molecular Weight:
342.26
Synonyms:
None
SMILES:
O=C1NC(=O)C(N1)(C2=CC=C(C=C2)N(=O)=O)C3=CC=C(C=C3)N(=O)=O
Tpsa:
144.48
Logp:
1.586
H Acceptors:
6
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: C₁₅H₃₀N₄O₉
Molecular Weight: 410.42
Synonyms: None
SMILES: O([C@H]1[C@H](O)[C@@H](O)[C@H](NC([C@H](CN)O)=O)C[C@@H]1N)[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2O
Tpsa: 247
Logp: -6.6049
H Acceptors: 12
H Donors: 10
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₃₀N₄O₉
Molecular Weight:
410.42
Synonyms:
None
SMILES:
O([C@H]1[C@H](O)[C@@H](O)[C@H](NC([C@H](CN)O)=O)C[C@@H]1N)[C@H]2O[C@H](CN)[C@@H](O)[C@H](O)[C@H]2O
Tpsa:
247
Logp:
-6.6049
H Acceptors:
12
H Donors:
10
Rotatable Bonds:
6