CS-0914634
Bromhexine Impurity 2
Manufacturer: ChemScene
CAS Number: 63471-27-2
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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
C₁₄H₂₁BrN₂
Molecular Weight
297.23
Synonyms
None
SMILES
BrC1=CC=CC(=C1N)CN(C)C2CCCCC2
Tpsa
29.26
Logp
3.7958
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: C₁₄H₂₁BrN₂
Molecular Weight: 297.23
Synonyms: None
SMILES: BrC1=CC=CC(=C1N)CN(C)C2CCCCC2
Tpsa: 29.26
Logp: 3.7958
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:
C₁₄H₂₁BrN₂
Molecular Weight:
297.23
Synonyms:
None
SMILES:
BrC1=CC=CC(=C1N)CN(C)C2CCCCC2
Tpsa:
29.26
Logp:
3.7958
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: C₆H₁₂N₂O₂
Molecular Weight: 144.17
Synonyms: None
SMILES: O=C(N)NC(=O)CC(C)C
Tpsa: 72.19
Logp: 0.2274
H Acceptors: 2
H Donors: 2
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:
C₆H₁₂N₂O₂
Molecular Weight:
144.17
Synonyms:
None
SMILES:
O=C(N)NC(=O)CC(C)C
Tpsa:
72.19
Logp:
0.2274
H Acceptors:
2
H Donors:
2
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: C₆H₁₂N₂O₃
Molecular Weight: 160.17
Synonyms: None
SMILES: O=C(N)NC(=O)C(O)C(C)C
Tpsa: 92.42
Logp: -0.8018
H Acceptors: 3
H Donors: 3
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:
C₆H₁₂N₂O₃
Molecular Weight:
160.17
Synonyms:
None
SMILES:
O=C(N)NC(=O)C(O)C(C)C
Tpsa:
92.42
Logp:
-0.8018
H Acceptors:
3
H Donors:
3
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: C₃₂H₄₀BrN₅O₅
Molecular Weight: 654.59
Synonyms: None
SMILES: O[C@]12N(C(=O)[C@](NC(=O)[C@@H]3C=C4C=5C=6C(C[C@]4(N(C)C3)[H])=C(Br)NC6C=CC5)([C@H](C)C)O1)[C@@H](CC(C)C)C(=O)N7[C@]2(CCC7)[H]
Tpsa: 118.21
Logp: 3.1928
H Acceptors: 6
H Donors: 3
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:
C₃₂H₄₀BrN₅O₅
Molecular Weight:
654.59
Synonyms:
None
SMILES:
O[C@]12N(C(=O)[C@](NC(=O)[C@@H]3C=C4C=5C=6C(C[C@]4(N(C)C3)[H])=C(Br)NC6C=CC5)([C@H](C)C)O1)[C@@H](CC(C)C)C(=O)N7[C@]2(CCC7)[H]
Tpsa:
118.21
Logp:
3.1928
H Acceptors:
6
H Donors:
3
Rotatable Bonds:
5