CS-0655217
(1S,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(1R,2E,4R)-4-Cyclopropyl-4-hydroxy-1-methyl-2-buten-1-yl]octahydro-7a-methyl-4H-inden-4-ylidene]ethylidene]-4-methylene-1,3-cyclohexanediol
Manufacturer: ChemScene
CAS Number: 112827-99-3
The price for this product is unavailable. Please request a quote
Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₇H₄₀O₃
Molecular Weight
412.60
Synonyms
None
SMILES
C[C@@]12[C@](CC[C@@H]2[C@@H](/C=C/[C@H](O)C3CC3)C)([H])/C(CCC1)=C/C=C4C[C@@H](O)C[C@H](O)C/4=C
Tpsa
60.69
Logp
5.0906
H Acceptors
3
H Donors
3
Rotatable Bonds
5
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 24R-Calcipotriol | ChemScene | ₹ 48,950.00 - ₹ 1,95,800.00 | |
 | 112827-99-3 | 24R-Calcipotriol | A2B Chem | ₹ 52,510.00 - ₹ 1,73,550.00 |
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SAFETY INFORMATION
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
P260-P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361+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: C₂₇H₄₀O₃
Molecular Weight: 412.60
Synonyms: None
SMILES: C[C@@]12[C@](CC[C@@H]2[C@@H](/C=C/[C@H](O)C3CC3)C)([H])/C(CCC1)=C/C=C4C[C@@H](O)C[C@H](O)C/4=C
Tpsa: 60.69
Logp: 5.0906
H Acceptors: 3
H Donors: 3
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:
C₂₇H₄₀O₃
Molecular Weight:
412.60
Synonyms:
None
SMILES:
C[C@@]12[C@](CC[C@@H]2[C@@H](/C=C/[C@H](O)C3CC3)C)([H])/C(CCC1)=C/C=C4C[C@@H](O)C[C@H](O)C/4=C
Tpsa:
60.69
Logp:
5.0906
H Acceptors:
3
H Donors:
3
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: C₁₄H₂₂N₂
Molecular Weight: 218.34
Synonyms: None
SMILES: CN[C@@H]([C@H](CC1)C)CN1CC2=CC=CC=C2
Tpsa: 15.27
Logp: 2.1164
H Acceptors: 2
H Donors: 1
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:
C₁₄H₂₂N₂
Molecular Weight:
218.34
Synonyms:
None
SMILES:
CN[C@@H]([C@H](CC1)C)CN1CC2=CC=CC=C2
Tpsa:
15.27
Logp:
2.1164
H Acceptors:
2
H Donors:
1
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: C₉H₁₃BrN₂S
Molecular Weight: 261.18
Synonyms: None
SMILES: CC1=C(Br)SC(C2CCNCC2)=N1
Tpsa: 24.92
Logp: 2.68102
H Acceptors: 3
H Donors: 1
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:
C₉H₁₃BrN₂S
Molecular Weight:
261.18
Synonyms:
None
SMILES:
CC1=C(Br)SC(C2CCNCC2)=N1
Tpsa:
24.92
Logp:
2.68102
H Acceptors:
3
H Donors:
1
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: C₁₄H₂₁BrN₂O₂S
Molecular Weight: 361.30
Synonyms: None
SMILES: O=C(N1CCC(C2=NC(C)=C(Br)S2)CC1)OC(C)(C)C
Tpsa: 42.43
Logp: 4.32852
H Acceptors: 4
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:
C₁₄H₂₁BrN₂O₂S
Molecular Weight:
361.30
Synonyms:
None
SMILES:
O=C(N1CCC(C2=NC(C)=C(Br)S2)CC1)OC(C)(C)C
Tpsa:
42.43
Logp:
4.32852
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
1