CS-0145749
4-Bromo-2-isopropoxy-5-methylaniline
Manufacturer: ChemScene
CAS Number: 2055376-62-8
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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
C₁₀H₁₄BrNO
Molecular Weight
244.13
Synonyms
None
SMILES
BrC1=C(C)C=C(N)C(OC(C)C)=C1
Tpsa
35.25
Logp
3.12692
H Acceptors
2
H Donors
1
Rotatable Bonds
2
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SAFETY INFORMATION
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: C₁₀H₁₄BrNO
Molecular Weight: 244.13
Synonyms: None
SMILES: BrC1=C(C)C=C(N)C(OC(C)C)=C1
Tpsa: 35.25
Logp: 3.12692
H Acceptors: 2
H Donors: 1
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:
C₁₀H₁₄BrNO
Molecular Weight:
244.13
Synonyms:
None
SMILES:
BrC1=C(C)C=C(N)C(OC(C)C)=C1
Tpsa:
35.25
Logp:
3.12692
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: -20°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₇NO₅
Molecular Weight: 291.30
Synonyms: None
SMILES: O=C(OC1=CC=C([N+]([O-])=O)C=C1)OC2/C=C/CCCCC2
Tpsa: 78.67
Logp: 3.9991
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
-20°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₇NO₅
Molecular Weight:
291.30
Synonyms:
None
SMILES:
O=C(OC1=CC=C([N+]([O-])=O)C=C1)OC2/C=C/CCCCC2
Tpsa:
78.67
Logp:
3.9991
H Acceptors:
5
H Donors:
0
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: C₂₁H₂₄N₄O₂S
Molecular Weight: 396.51
Synonyms: (S)-YM178; rabegron Impurity 1 (Mirabegron Enantiomer)
SMILES: O=C(CC1=CSC(N)=N1)NC2=CC=C(C=C2)CCNC[C@H](C3=CC=CC=C3)O
Tpsa: 100.27
Logp: 2.7722
H Acceptors: 6
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:
C₂₁H₂₄N₄O₂S
Molecular Weight:
396.51
Synonyms:
(S)-YM178; rabegron Impurity 1 (Mirabegron Enantiomer)
SMILES:
O=C(CC1=CSC(N)=N1)NC2=CC=C(C=C2)CCNC[C@H](C3=CC=CC=C3)O
Tpsa:
100.27
Logp:
2.7722
H Acceptors:
6
H Donors:
4
Rotatable Bonds:
9
Purity: 97%
MDL No: MFCD00075591
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₃NO₂
Molecular Weight: 179.22
Synonyms: 4-(Dimethylamino)phenylacetic acid
SMILES: O=C(O)CC1=CC=C(N(C)C)C=C1
Tpsa: 40.54
Logp: 1.3797
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
97%
MDL No:
MFCD00075591
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₃NO₂
Molecular Weight:
179.22
Synonyms:
4-(Dimethylamino)phenylacetic acid
SMILES:
O=C(O)CC1=CC=C(N(C)C)C=C1
Tpsa:
40.54
Logp:
1.3797
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3