CS-0653688
Methyl (2E)-7-[(1R,2R,3R,5S)-5-(acetyloxy)-2-[(1E,5S)-5-methyl-3-oxo-1-nonen-1-yl]-3-[(tetrahydro-2H-pyran-2-yl)oxy]cyclopentyl]-2-heptenoate
Manufacturer: ChemScene
CAS Number: 1574525-34-0
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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
C₃₀H₄₈O₇
Molecular Weight
520.70
Synonyms
None
SMILES
O=C(OC)/C=C/CCCC[C@@H]1[C@@H](/C=C/C(C[C@@H](C)CCCC)=O)[C@H](OC2CCCCO2)C[C@@H]1OC(C)=O
Tpsa
88.13
Logp
6.0973
H Acceptors
7
H Donors
0
Rotatable Bonds
16
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: C₃₀H₄₈O₇
Molecular Weight: 520.70
Synonyms: None
SMILES: O=C(OC)/C=C/CCCC[C@@H]1[C@@H](/C=C/C(C[C@@H](C)CCCC)=O)[C@H](OC2CCCCO2)C[C@@H]1OC(C)=O
Tpsa: 88.13
Logp: 6.0973
H Acceptors: 7
H Donors: 0
Rotatable Bonds: 16
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₀H₄₈O₇
Molecular Weight:
520.70
Synonyms:
None
SMILES:
O=C(OC)/C=C/CCCC[C@@H]1[C@@H](/C=C/C(C[C@@H](C)CCCC)=O)[C@H](OC2CCCCO2)C[C@@H]1OC(C)=O
Tpsa:
88.13
Logp:
6.0973
H Acceptors:
7
H Donors:
0
Rotatable Bonds:
16
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₈H₂₈BrOP
Molecular Weight: 491.40
Synonyms: None
SMILES: C1(COCCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)=CC=CC=C1.[Br-]
Tpsa: 9.23
Logp: 2.5914
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₂₈BrOP
Molecular Weight:
491.40
Synonyms:
None
SMILES:
C1(COCCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)=CC=CC=C1.[Br-]
Tpsa:
9.23
Logp:
2.5914
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₆Cl₂
Molecular Weight: 161.03
Synonyms: 1-Chloro-3-(chloromethyl)benzene
SMILES: ClCC1=CC(Cl)=CC=C1
Tpsa: 0
Logp: 3.0788
H Acceptors: 0
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:
C₇H₆Cl₂
Molecular Weight:
161.03
Synonyms:
1-Chloro-3-(chloromethyl)benzene
SMILES:
ClCC1=CC(Cl)=CC=C1
Tpsa:
0
Logp:
3.0788
H Acceptors:
0
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: C₂₇H₄₂O₂
Molecular Weight: 398.62
Synonyms: None
SMILES: C[C@@]12[C@]3([H])C([C@@]4([H])[C@](CC3)([C@@](CC4)([H])[C@H](C)CCCC(C)C)C)=CC=C1C[C@H]([C@@]5([H])[C@]2([H])O5)O
Tpsa: 32.76
Logp: 6.296
H Acceptors: 2
H Donors: 1
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:
C₂₇H₄₂O₂
Molecular Weight:
398.62
Synonyms:
None
SMILES:
C[C@@]12[C@]3([H])C([C@@]4([H])[C@](CC3)([C@@](CC4)([H])[C@H](C)CCCC(C)C)C)=CC=C1C[C@H]([C@@]5([H])[C@]2([H])O5)O
Tpsa:
32.76
Logp:
6.296
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
5