CS-0875399
1-[(3R,3aS,5S,6S,7aR)-Octahydro-3a,6-dihydroxy-7a-methyl-3-(1-methylethyl)-1H-inden-5-yl]ethanone
Manufacturer: ChemScene
CAS Number: 457949-49-4
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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
C₁₅H₂₆O₃
Molecular Weight
254.37
Synonyms
None
SMILES
O[C@@]12[C@@](C[C@@H]([C@H](C1)C(C)=O)O)(CC[C@@H]2C(C)C)C
Tpsa
57.53
Logp
2.0056
H Acceptors
3
H Donors
2
Rotatable Bonds
2
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: C₁₅H₂₆O₃
Molecular Weight: 254.37
Synonyms: None
SMILES: O[C@@]12[C@@](C[C@@H]([C@H](C1)C(C)=O)O)(CC[C@@H]2C(C)C)C
Tpsa: 57.53
Logp: 2.0056
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:
C₁₅H₂₆O₃
Molecular Weight:
254.37
Synonyms:
None
SMILES:
O[C@@]12[C@@](C[C@@H]([C@H](C1)C(C)=O)O)(CC[C@@H]2C(C)C)C
Tpsa:
57.53
Logp:
2.0056
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: C₆H₁₂N₂O₂
Molecular Weight: 144.17
Synonyms: None
SMILES: CC(C)[C@H]1COC(=O)N1N
Tpsa: 55.56
Logp: 0.3369
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:
C₆H₁₂N₂O₂
Molecular Weight:
144.17
Synonyms:
None
SMILES:
CC(C)[C@H]1COC(=O)N1N
Tpsa:
55.56
Logp:
0.3369
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: C₇H₁₄N₂O₂
Molecular Weight: 158.20
Synonyms: None
SMILES: C1CNCCC1[C@@H](C(=O)O)N
Tpsa: 75.35
Logp: -0.6021
H Acceptors: 3
H Donors: 3
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:
C₇H₁₄N₂O₂
Molecular Weight:
158.20
Synonyms:
None
SMILES:
C1CNCCC1[C@@H](C(=O)O)N
Tpsa:
75.35
Logp:
-0.6021
H Acceptors:
3
H Donors:
3
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: C₈H₆BF₃O₄
Molecular Weight: 233.94
Synonyms: None
SMILES: B(C1=C(C=CC(=C1)C=O)OC(F)(F)F)(O)O
Tpsa: 66.76
Logp: 0.0775
H Acceptors: 4
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:
C₈H₆BF₃O₄
Molecular Weight:
233.94
Synonyms:
None
SMILES:
B(C1=C(C=CC(=C1)C=O)OC(F)(F)F)(O)O
Tpsa:
66.76
Logp:
0.0775
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
3