CS-1000135
Ibutilide Impurity 9
Manufacturer: ChemScene
CAS Number: 100633-01-0
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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
C₂₀H₃₆N₂O₃S
Molecular Weight
384.58
Synonyms
None
SMILES
O=S(=O)(NC1=CC=CC(=C1)C(O)CCCN(CC)CCCCCCC)C
Tpsa
69.64
Logp
4.164
H Acceptors
4
H Donors
2
Rotatable Bonds
14
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: C₂₀H₃₆N₂O₃S
Molecular Weight: 384.58
Synonyms: None
SMILES: O=S(=O)(NC1=CC=CC(=C1)C(O)CCCN(CC)CCCCCCC)C
Tpsa: 69.64
Logp: 4.164
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 14
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₃₆N₂O₃S
Molecular Weight:
384.58
Synonyms:
None
SMILES:
O=S(=O)(NC1=CC=CC(=C1)C(O)CCCN(CC)CCCCCCC)C
Tpsa:
69.64
Logp:
4.164
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
14
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₁NO₂
Molecular Weight: 259.34
Synonyms: None
SMILES: O=C1C2=CC=C(O)C=C2C3(C)CCCCCC1C3N
Tpsa: 63.32
Logp: 2.7538
H Acceptors: 3
H Donors: 2
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:
C₁₆H₂₁NO₂
Molecular Weight:
259.34
Synonyms:
None
SMILES:
O=C1C2=CC=C(O)C=C2C3(C)CCCCCC1C3N
Tpsa:
63.32
Logp:
2.7538
H Acceptors:
3
H Donors:
2
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: C₇H₆Br₃N
Molecular Weight: 343.84
Synonyms: None
SMILES: BrC=1C=C(Br)C(N)=C(C1)CBr
Tpsa: 26.02
Logp: 3.6887
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:
C₇H₆Br₃N
Molecular Weight:
343.84
Synonyms:
None
SMILES:
BrC=1C=C(Br)C(N)=C(C1)CBr
Tpsa:
26.02
Logp:
3.6887
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: C₇H₆Br₂ClN
Molecular Weight: 299.39
Synonyms: None
SMILES: ClCC=1C=C(Br)C=C(Br)C1N
Tpsa: 26.02
Logp: 3.5326
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:
C₇H₆Br₂ClN
Molecular Weight:
299.39
Synonyms:
None
SMILES:
ClCC=1C=C(Br)C=C(Br)C1N
Tpsa:
26.02
Logp:
3.5326
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
1