CS-0173419
(1R,3aS,7aR)-1-((2R)-6-(1-Ethoxyethoxy)-6-methylhept-4-yn-2-yl)-7a-methyloctahydro-4H-inden-4-one
Manufacturer: ChemScene
CAS Number: 386766-74-1
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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
C₂₂H₃₆O₃
Molecular Weight
348.52
Synonyms
None
SMILES
O=C1[C@@]2([H])CC[C@H]([C@H](C)CC#CC(C)(OC(OCC)C)C)[C@@]2(C)CCC1
Tpsa
35.53
Logp
4.9792
H Acceptors
3
H Donors
0
Rotatable Bonds
6
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: C₂₂H₃₆O₃
Molecular Weight: 348.52
Synonyms: None
SMILES: O=C1[C@@]2([H])CC[C@H]([C@H](C)CC#CC(C)(OC(OCC)C)C)[C@@]2(C)CCC1
Tpsa: 35.53
Logp: 4.9792
H Acceptors: 3
H Donors: 0
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:
C₂₂H₃₆O₃
Molecular Weight:
348.52
Synonyms:
None
SMILES:
O=C1[C@@]2([H])CC[C@H]([C@H](C)CC#CC(C)(OC(OCC)C)C)[C@@]2(C)CCC1
Tpsa:
35.53
Logp:
4.9792
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
6
Purity: 97%
MDL No: MFCD02577632
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₂N₄O₃
Molecular Weight: 272.26
Synonyms: 5-NITRO-2-[(PYRIDIN-3-YLMETHYL)AMINO]BENZAMIDE
SMILES: O=C(N)C1=CC([N+]([O-])=O)=CC=C1NCC2=CC=CN=C2
Tpsa: 111.15
Logp: 1.7008
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 5
Purity:
97%
MDL No:
MFCD02577632
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₂N₄O₃
Molecular Weight:
272.26
Synonyms:
5-NITRO-2-[(PYRIDIN-3-YLMETHYL)AMINO]BENZAMIDE
SMILES:
O=C(N)C1=CC([N+]([O-])=O)=CC=C1NCC2=CC=CN=C2
Tpsa:
111.15
Logp:
1.7008
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
5
Purity: 97%
MDL No: MFCD00055578
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₂₂O
Molecular Weight: 182.30
Synonyms: None
SMILES: O[C@]12[C@@](CCCC1)(CCC[C@H]2C)C
Tpsa: 20.23
Logp: 3.1178
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 0
Purity:
97%
MDL No:
MFCD00055578
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₂₂O
Molecular Weight:
182.30
Synonyms:
None
SMILES:
O[C@]12[C@@](CCCC1)(CCC[C@H]2C)C
Tpsa:
20.23
Logp:
3.1178
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: MFCD00664674
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₁ClN₄
Molecular Weight: 234.68
Synonyms: None
SMILES: NC1=NC(Cl)=CC(NCC2=CC=CC=C2)=N1
Tpsa: 63.83
Logp: 2.3243
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD00664674
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₁ClN₄
Molecular Weight:
234.68
Synonyms:
None
SMILES:
NC1=NC(Cl)=CC(NCC2=CC=CC=C2)=N1
Tpsa:
63.83
Logp:
2.3243
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
3