CS-0534179
4-(1-Hydroxy-2-((4-phenylbutyl)amino)ethyl)-2-(hydroxymethyl)phenol Salmeterol Impurity
Manufacturer: ChemScene
CAS Number: 1798014-51-3
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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
C₁₉H₂₅NO₃
Molecular Weight
315.41
Synonyms
None
SMILES
OC1=CC=C(C(CNCCCCC2=CC=CC=C2)O)C=C1CO
Tpsa
72.72
Logp
2.5304
H Acceptors
4
H Donors
4
Rotatable Bonds
9
SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₁₉H₂₅NO₃
Molecular Weight: 315.41
Synonyms: None
SMILES: OC1=CC=C(C(CNCCCCC2=CC=CC=C2)O)C=C1CO
Tpsa: 72.72
Logp: 2.5304
H Acceptors: 4
H Donors: 4
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:
C₁₉H₂₅NO₃
Molecular Weight:
315.41
Synonyms:
None
SMILES:
OC1=CC=C(C(CNCCCCC2=CC=CC=C2)O)C=C1CO
Tpsa:
72.72
Logp:
2.5304
H Acceptors:
4
H Donors:
4
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: C₂₅H₃₇NO₃
Molecular Weight: 399.57
Synonyms: 3-De(hydroxymethyl)-3-methyl Salmeterol
SMILES: OC1=CC=C(C(CNCCCCCCOCCCCC2=CC=CC=C2)O)C=C1C
Tpsa: 61.72
Logp: 4.92352
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 15
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₅H₃₇NO₃
Molecular Weight:
399.57
Synonyms:
3-De(hydroxymethyl)-3-methyl Salmeterol
SMILES:
OC1=CC=C(C(CNCCCCCCOCCCCC2=CC=CC=C2)O)C=C1C
Tpsa:
61.72
Logp:
4.92352
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
15
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₃₀O
Molecular Weight: 310.47
Synonyms: Desogestrel delta 3-isomer
SMILES: CC[C@@]12[C@](CC[C@@]2(O)C#C)([H])[C@@]3([H])[C@]([C@]4([H])[C@@](C=CCC4)([H])CC3)([H])C(C1)=C
Tpsa: 20.23
Logp: 4.7256
H Acceptors: 1
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:
C₂₂H₃₀O
Molecular Weight:
310.47
Synonyms:
Desogestrel delta 3-isomer
SMILES:
CC[C@@]12[C@](CC[C@@]2(O)C#C)([H])[C@@]3([H])[C@]([C@]4([H])[C@@](C=CCC4)([H])CC3)([H])C(C1)=C
Tpsa:
20.23
Logp:
4.7256
H Acceptors:
1
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: C₂₁H₂₄O₂
Molecular Weight: 308.41
Synonyms: Levonorgestrel Impurity W
SMILES: CC[C@@]12[C@](CC[C@@]2(O)C#C)([H])C3=CC=C(CC(CC4)=O)C4=C3CC1
Tpsa: 37.3
Logp: 3.3287
H Acceptors: 2
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:
C₂₁H₂₄O₂
Molecular Weight:
308.41
Synonyms:
Levonorgestrel Impurity W
SMILES:
CC[C@@]12[C@](CC[C@@]2(O)C#C)([H])C3=CC=C(CC(CC4)=O)C4=C3CC1
Tpsa:
37.3
Logp:
3.3287
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1