CS-1037057
N-(4-Chloro-3-methylbenzyl)but-3-yn-2-amine
Manufacturer: ChemScene
CAS Number: 1864832-08-5
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₂H₁₄ClN
Molecular Weight
207.70
Synonyms
None
SMILES
ClC1=CC=C(C=C1C)CNC(C#C)C
Tpsa
12.03
Logp
2.75972
H Acceptors
1
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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₄ClN
Molecular Weight: 207.70
Synonyms: None
SMILES: ClC1=CC=C(C=C1C)CNC(C#C)C
Tpsa: 12.03
Logp: 2.75972
H Acceptors: 1
H Donors: 1
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:
C₁₂H₁₄ClN
Molecular Weight:
207.70
Synonyms:
None
SMILES:
ClC1=CC=C(C=C1C)CNC(C#C)C
Tpsa:
12.03
Logp:
2.75972
H Acceptors:
1
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: C₁₅H₂₀BrN₅O₄
Molecular Weight: 414.25
Synonyms: None
SMILES: O=C(N(C1=NN2C=C(Br)N=CC2=N1)C(OC(C)(C)C)=O)OC(C)(C)C
Tpsa: 98.92
Logp: 3.5634
H Acceptors: 8
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:
C₁₅H₂₀BrN₅O₄
Molecular Weight:
414.25
Synonyms:
None
SMILES:
O=C(N(C1=NN2C=C(Br)N=CC2=N1)C(OC(C)(C)C)=O)OC(C)(C)C
Tpsa:
98.92
Logp:
3.5634
H Acceptors:
8
H Donors:
0
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₂₁Cl
Molecular Weight: 188.74
Synonyms: None
SMILES: ClCCCC1CCC(C)(C)CC1
Tpsa: 0
Logp: 4.2218
H Acceptors: 0
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:
C₁₁H₂₁Cl
Molecular Weight:
188.74
Synonyms:
None
SMILES:
ClCCCC1CCC(C)(C)CC1
Tpsa:
0
Logp:
4.2218
H Acceptors:
0
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: C₉H₁₅NOS
Molecular Weight: 185.29
Synonyms: None
SMILES: OC(C1=CSC(=C1)C)C(C)CN
Tpsa: 46.25
Logp: 1.68472
H Acceptors: 3
H Donors: 2
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:
C₉H₁₅NOS
Molecular Weight:
185.29
Synonyms:
None
SMILES:
OC(C1=CSC(=C1)C)C(C)CN
Tpsa:
46.25
Logp:
1.68472
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
3