CS-0765475
3-Bromo-4-((4-Methylpiperazin-1-yl)methyl)benzoic acid
Manufacturer: ChemScene
CAS Number: 765269-29-2
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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
C₁₃H₁₇BrN₂O₂
Molecular Weight
313.19
Synonyms
None
SMILES
CN1CCN(CC2=CC=C(C=C2Br)C(O)=O)CC1
Tpsa
43.78
Logp
1.8947
H Acceptors
3
H Donors
1
Rotatable Bonds
3
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: C₁₃H₁₇BrN₂O₂
Molecular Weight: 313.19
Synonyms: None
SMILES: CN1CCN(CC2=CC=C(C=C2Br)C(O)=O)CC1
Tpsa: 43.78
Logp: 1.8947
H Acceptors: 3
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:
C₁₃H₁₇BrN₂O₂
Molecular Weight:
313.19
Synonyms:
None
SMILES:
CN1CCN(CC2=CC=C(C=C2Br)C(O)=O)CC1
Tpsa:
43.78
Logp:
1.8947
H Acceptors:
3
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: C₁₀H₁₂BrN
Molecular Weight: 226.11
Synonyms: None
SMILES: N[C@@H]1CCC2=C(C1)C(Br)=CC=C2
Tpsa: 26.02
Logp: 2.2651
H Acceptors: 1
H Donors: 1
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:
C₁₀H₁₂BrN
Molecular Weight:
226.11
Synonyms:
None
SMILES:
N[C@@H]1CCC2=C(C1)C(Br)=CC=C2
Tpsa:
26.02
Logp:
2.2651
H Acceptors:
1
H Donors:
1
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: C₁₅H₁₃NO
Molecular Weight: 223.27
Synonyms: None
SMILES: O=C(N1C2=C(CC1)C=CC=C2)C3=CC=CC=C3
Tpsa: 20.31
Logp: 2.8895
H Acceptors: 1
H Donors: 0
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:
C₁₅H₁₃NO
Molecular Weight:
223.27
Synonyms:
None
SMILES:
O=C(N1C2=C(CC1)C=CC=C2)C3=CC=CC=C3
Tpsa:
20.31
Logp:
2.8895
H Acceptors:
1
H Donors:
0
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: C₁₈H₂₁NO₃
Molecular Weight: 299.36
Synonyms: None
SMILES: CCOC(=O)CN[C@H]([C@H](O)C1=CC=CC=C1)C1=CC=CC=C1
Tpsa: 58.56
Logp: 2.614
H Acceptors: 4
H Donors: 2
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:
C₁₈H₂₁NO₃
Molecular Weight:
299.36
Synonyms:
None
SMILES:
CCOC(=O)CN[C@H]([C@H](O)C1=CC=CC=C1)C1=CC=CC=C1
Tpsa:
58.56
Logp:
2.614
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
7