CS-0767351
2-(1,4-Diazepan-1-Yl)-5-propylbenzenesulfonic acid
Manufacturer: ChemScene
CAS Number: 133804-52-1
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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
C₁₄H₂₂N₂O₃S
Molecular Weight
298.40
Synonyms
None
SMILES
CCCC1=CC(=C(C=C1)N1CCCNCC1)S(O)(=O)=O
Tpsa
69.64
Logp
1.6855
H Acceptors
4
H Donors
2
Rotatable Bonds
4
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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: C₁₄H₂₂N₂O₃S
Molecular Weight: 298.40
Synonyms: None
SMILES: CCCC1=CC(=C(C=C1)N1CCCNCC1)S(O)(=O)=O
Tpsa: 69.64
Logp: 1.6855
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₂N₂O₃S
Molecular Weight:
298.40
Synonyms:
None
SMILES:
CCCC1=CC(=C(C=C1)N1CCCNCC1)S(O)(=O)=O
Tpsa:
69.64
Logp:
1.6855
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₈F₂O₂
Molecular Weight: 198.17
Synonyms: None
SMILES: O=C(C(F)(C(C)=O)F)C1=CC=CC=C1
Tpsa: 34.14
Logp: 2.0936
H Acceptors: 2
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:
C₁₀H₈F₂O₂
Molecular Weight:
198.17
Synonyms:
None
SMILES:
O=C(C(F)(C(C)=O)F)C1=CC=CC=C1
Tpsa:
34.14
Logp:
2.0936
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
3
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₀ClNO₂
Molecular Weight: 223.66
Synonyms: None
SMILES: COC1=CC(OC)=C2C=NC(Cl)=CC2=C1
Tpsa: 31.35
Logp: 2.9054
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 2
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₀ClNO₂
Molecular Weight:
223.66
Synonyms:
None
SMILES:
COC1=CC(OC)=C2C=NC(Cl)=CC2=C1
Tpsa:
31.35
Logp:
2.9054
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₉IN₂O₂
Molecular Weight: 280.06
Synonyms: None
SMILES: CN1C(C)=C(I)C(=O)N(C)C1=O
Tpsa: 44
Logp: -0.00298
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 0
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₉IN₂O₂
Molecular Weight:
280.06
Synonyms:
None
SMILES:
CN1C(C)=C(I)C(=O)N(C)C1=O
Tpsa:
44
Logp:
-0.00298
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
0