CS-1001846
Bromhexine Ep Impurity I
Manufacturer: ChemScene
CAS Number: 1631131-52-6
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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
C₁₄H₂₀BrClN₂
Molecular Weight
331.68
Synonyms
None
SMILES
ClC=1C=C(Br)C=C(C1N)CN(C)C2CCCCC2
Tpsa
29.26
Logp
4.4492
H Acceptors
2
H Donors
1
Rotatable Bonds
3
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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: C₁₄H₂₀BrClN₂
Molecular Weight: 331.68
Synonyms: None
SMILES: ClC=1C=C(Br)C=C(C1N)CN(C)C2CCCCC2
Tpsa: 29.26
Logp: 4.4492
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₀BrClN₂
Molecular Weight:
331.68
Synonyms:
None
SMILES:
ClC=1C=C(Br)C=C(C1N)CN(C)C2CCCCC2
Tpsa:
29.26
Logp:
4.4492
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₆BrCl₂N
Molecular Weight: 254.94
Synonyms: None
SMILES: ClC=1C=C(Br)C=C(C1N)CCl
Tpsa: 26.02
Logp: 3.4235
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:
C₇H₆BrCl₂N
Molecular Weight:
254.94
Synonyms:
None
SMILES:
ClC=1C=C(Br)C=C(C1N)CCl
Tpsa:
26.02
Logp:
3.4235
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: C₂₄H₂₀FNO₃
Molecular Weight: 389.42
Synonyms: None
SMILES: C(CC(=O)C1=CC=CC=C1)[C@@H]2[C@H](N(C2=O)C3=CC=C(F)C=C3)C4=CC=C(O)C=C4
Tpsa: 57.61
Logp: 4.8985
H Acceptors: 3
H Donors: 1
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:
C₂₄H₂₀FNO₃
Molecular Weight:
389.42
Synonyms:
None
SMILES:
C(CC(=O)C1=CC=CC=C1)[C@@H]2[C@H](N(C2=O)C3=CC=C(F)C=C3)C4=CC=C(O)C=C4
Tpsa:
57.61
Logp:
4.8985
H Acceptors:
3
H Donors:
1
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: C₂₄H₂₉N₃O₇S
Molecular Weight: 503.57
Synonyms: None
SMILES: C(O)(=O)C=1N2[C@@]([C@@]([C@@H](C)O)(C2=O)[H])([C@@H](C)C1S[C@H]3C[C@@H](C(NC4=CC(C(OCC)=O)=CC=C4)=O)NC3)[H]
Tpsa: 145.27
Logp: 1.4192
H Acceptors: 8
H Donors: 4
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₂₉N₃O₇S
Molecular Weight:
503.57
Synonyms:
None
SMILES:
C(O)(=O)C=1N2[C@@]([C@@]([C@@H](C)O)(C2=O)[H])([C@@H](C)C1S[C@H]3C[C@@H](C(NC4=CC(C(OCC)=O)=CC=C4)=O)NC3)[H]
Tpsa:
145.27
Logp:
1.4192
H Acceptors:
8
H Donors:
4
Rotatable Bonds:
8