CS-0577721
4-Methoxy-3-(pyrrolidin-1-ylmethyl)benzoic acid hydrochloride
Manufacturer: ChemScene
CAS Number: 1185058-72-3
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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
C₁₃H₁₈ClNO₃
Molecular Weight
271.74
Synonyms
4-Methoxy-3-pyrrolidin-1-ylmethyl-benzoic acidhydrochloride
SMILES
COC1=C(C=C(C=C1)C(=O)O)CN2CCCC2.Cl
Tpsa
49.77
Logp
2.411
H Acceptors
3
H Donors
1
Rotatable Bonds
4
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: C₁₃H₁₈ClNO₃
Molecular Weight: 271.74
Synonyms: 4-Methoxy-3-pyrrolidin-1-ylmethyl-benzoic acidhydrochloride
SMILES: COC1=C(C=C(C=C1)C(=O)O)CN2CCCC2.Cl
Tpsa: 49.77
Logp: 2.411
H Acceptors: 3
H Donors: 1
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:
C₁₃H₁₈ClNO₃
Molecular Weight:
271.74
Synonyms:
4-Methoxy-3-pyrrolidin-1-ylmethyl-benzoic acidhydrochloride
SMILES:
COC1=C(C=C(C=C1)C(=O)O)CN2CCCC2.Cl
Tpsa:
49.77
Logp:
2.411
H Acceptors:
3
H Donors:
1
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: C₁₄H₂₀ClNO₃
Molecular Weight: 285.77
Synonyms: 2-Propoxy-5-pyrrolidin-1-yl-benzoic acid hydrochloride
SMILES: CCCOC1=C(C=C(C=C1)N2CCCC2)C(=O)O.Cl
Tpsa: 49.77
Logp: 3.1956
H Acceptors: 3
H Donors: 1
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:
C₁₄H₂₀ClNO₃
Molecular Weight:
285.77
Synonyms:
2-Propoxy-5-pyrrolidin-1-yl-benzoic acid hydrochloride
SMILES:
CCCOC1=C(C=C(C=C1)N2CCCC2)C(=O)O.Cl
Tpsa:
49.77
Logp:
3.1956
H Acceptors:
3
H Donors:
1
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: C₁₀H₁₃ClFNO₂
Molecular Weight: 233.67
Synonyms: 3-[(2-Fluoro-phenyl)-methyl-amino]-propionic acidhydrochloride
SMILES: CN(CCC(=O)O)C1=CC=CC=C1F.Cl
Tpsa: 40.54
Logp: 2.1584
H Acceptors: 2
H Donors: 1
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:
C₁₀H₁₃ClFNO₂
Molecular Weight:
233.67
Synonyms:
3-[(2-Fluoro-phenyl)-methyl-amino]-propionic acidhydrochloride
SMILES:
CN(CCC(=O)O)C1=CC=CC=C1F.Cl
Tpsa:
40.54
Logp:
2.1584
H Acceptors:
2
H Donors:
1
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: C₁₂H₁₉ClN₂
Molecular Weight: 226.75
Synonyms: None
SMILES: C1CNCCC1CC2=CC=C(C=C2)N.Cl
Tpsa: 38.05
Logp: 2.2327
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:
C₁₂H₁₉ClN₂
Molecular Weight:
226.75
Synonyms:
None
SMILES:
C1CNCCC1CC2=CC=C(C=C2)N.Cl
Tpsa:
38.05
Logp:
2.2327
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
2