CS-1139469
Methyl 3-(pyrrolidin-3-ylmethyl)benzoate hydrochloride
Manufacturer: ChemScene
CAS Number: 1187172-07-1
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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
C₁₃H₁₈ClNO₂
Molecular Weight
255.74
Synonyms
None
SMILES
Cl.O=C(OC)C1=CC=CC(=C1)CC2CNCC2
Tpsa
38.33
Logp
2.047
H Acceptors
3
H Donors
1
Rotatable Bonds
3
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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: C₁₃H₁₈ClNO₂
Molecular Weight: 255.74
Synonyms: None
SMILES: Cl.O=C(OC)C1=CC=CC(=C1)CC2CNCC2
Tpsa: 38.33
Logp: 2.047
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:
C₁₃H₁₈ClNO₂
Molecular Weight:
255.74
Synonyms:
None
SMILES:
Cl.O=C(OC)C1=CC=CC(=C1)CC2CNCC2
Tpsa:
38.33
Logp:
2.047
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: C₁₀H₁₆Si
Molecular Weight: 164.32
Synonyms: None
SMILES: C=1C=CC(=C(C1)C)[Si](C)(C)C
Tpsa: 0
Logp: 2.54022
H Acceptors: 0
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:
C₁₀H₁₆Si
Molecular Weight:
164.32
Synonyms:
None
SMILES:
C=1C=CC(=C(C1)C)[Si](C)(C)C
Tpsa:
0
Logp:
2.54022
H Acceptors:
0
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: C₁₂H₁₂N₂O₄
Molecular Weight: 248.24
Synonyms: None
SMILES: O=C1C2=CC=C(C=C2C(=O)N1CCCC)N(=O)=O
Tpsa: 80.52
Logp: 1.9909
H Acceptors: 4
H Donors: 0
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:
C₁₂H₁₂N₂O₄
Molecular Weight:
248.24
Synonyms:
None
SMILES:
O=C1C2=CC=C(C=C2C(=O)N1CCCC)N(=O)=O
Tpsa:
80.52
Logp:
1.9909
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₀N₄O₂S
Molecular Weight: 214.24
Synonyms: None
SMILES: O=S(=O)(N)C1=CC=C(C=C1)NC(=N)N
Tpsa: 122.06
Logp: -0.36063
H Acceptors: 3
H Donors: 4
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:
C₇H₁₀N₄O₂S
Molecular Weight:
214.24
Synonyms:
None
SMILES:
O=S(=O)(N)C1=CC=C(C=C1)NC(=N)N
Tpsa:
122.06
Logp:
-0.36063
H Acceptors:
3
H Donors:
4
Rotatable Bonds:
2