CS-1002507
Metaraminol Impurity 9
Manufacturer: ChemScene
CAS Number: 20727-99-5
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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
C₉H₁₃NO₃
Molecular Weight
183.20
Synonyms
None
SMILES
[C@@H]([C@@H](C)N)(O)C1=CC(O)=C(O)C=C1
Tpsa
86.71
Logp
0.4784
H Acceptors
4
H Donors
4
Rotatable Bonds
2
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: C₉H₁₃NO₃
Molecular Weight: 183.20
Synonyms: None
SMILES: [C@@H]([C@@H](C)N)(O)C1=CC(O)=C(O)C=C1
Tpsa: 86.71
Logp: 0.4784
H Acceptors: 4
H Donors: 4
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:
C₉H₁₃NO₃
Molecular Weight:
183.20
Synonyms:
None
SMILES:
[C@@H]([C@@H](C)N)(O)C1=CC(O)=C(O)C=C1
Tpsa:
86.71
Logp:
0.4784
H Acceptors:
4
H Donors:
4
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: C₈H₈N₁₀
Molecular Weight: 244.22
Synonyms: None
SMILES: N=1C(=NC(N)=C2N=C3C(N=C(N=C3N)N)=NC12)N
Tpsa: 181.42
Logp: -1.3082
H Acceptors: 10
H Donors: 4
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈N₁₀
Molecular Weight:
244.22
Synonyms:
None
SMILES:
N=1C(=NC(N)=C2N=C3C(N=C(N=C3N)N)=NC12)N
Tpsa:
181.42
Logp:
-1.3082
H Acceptors:
10
H Donors:
4
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₁H₃₈O₈S
Molecular Weight: 570.69
Synonyms: None
SMILES: C[C@@]12[C@@]3([C@]([C@]4([C@](C)(C[C@H]3OS(=O)(=O)C5=CC=C(C)C=C5)[C@]6(CC4)OC(=O)CC6)[H])([C@H](C(OC)=O)CC1=CC(=O)CC2)[H])[H]
Tpsa: 113.04
Logp: 4.68562
H Acceptors: 8
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₁H₃₈O₈S
Molecular Weight:
570.69
Synonyms:
None
SMILES:
C[C@@]12[C@@]3([C@]([C@]4([C@](C)(C[C@H]3OS(=O)(=O)C5=CC=C(C)C=C5)[C@]6(CC4)OC(=O)CC6)[H])([C@H](C(OC)=O)CC1=CC(=O)CC2)[H])[H]
Tpsa:
113.04
Logp:
4.68562
H Acceptors:
8
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄₅H₅₂N₄O₈
Molecular Weight: 776.92
Synonyms: None
SMILES: C(C)[C@@]12[C@]3([C@@]45[C@]([C@@](C(OC)=O)([C@@H]1OC(C)=O)O[C@@]2(C=CN3CC4)[H])(N(C)C=6C5=CC(=C(OC)C6)[C@]7(C(OC)=O)C8=C(C=9C(N8)=CC=CC9)C[N@@]%10C[C@](C7)(C=C(CC)C%10)[H])[H])[H]
Tpsa: 122.87
Logp: 5.1176
H Acceptors: 11
H Donors: 1
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₅H₅₂N₄O₈
Molecular Weight:
776.92
Synonyms:
None
SMILES:
C(C)[C@@]12[C@]3([C@@]45[C@]([C@@](C(OC)=O)([C@@H]1OC(C)=O)O[C@@]2(C=CN3CC4)[H])(N(C)C=6C5=CC(=C(OC)C6)[C@]7(C(OC)=O)C8=C(C=9C(N8)=CC=CC9)C[N@@]%10C[C@](C7)(C=C(CC)C%10)[H])[H])[H]
Tpsa:
122.87
Logp:
5.1176
H Acceptors:
11
H Donors:
1
Rotatable Bonds:
7