CS-0555772
Methyl 1-(4-bromobenzyl)-1H-indole-3-carboxylate
Manufacturer: ChemScene
CAS Number: 709004-41-1
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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
C₁₇H₁₄BrNO₂
Molecular Weight
344.20
Synonyms
1h-indole-3-carboxylic acid,1-[(4-bromophenyl)methyl]-,methyl ester
SMILES
COC(=O)C1=CN(C2=CC=CC=C21)CC3=CC=C(C=C3)Br
Tpsa
31.23
Logp
4.2387
H Acceptors
3
H Donors
0
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: C₁₇H₁₄BrNO₂
Molecular Weight: 344.20
Synonyms: 1h-indole-3-carboxylic acid,1-[(4-bromophenyl)methyl]-,methyl ester
SMILES: COC(=O)C1=CN(C2=CC=CC=C21)CC3=CC=C(C=C3)Br
Tpsa: 31.23
Logp: 4.2387
H Acceptors: 3
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:
C₁₇H₁₄BrNO₂
Molecular Weight:
344.20
Synonyms:
1h-indole-3-carboxylic acid,1-[(4-bromophenyl)methyl]-,methyl ester
SMILES:
COC(=O)C1=CN(C2=CC=CC=C21)CC3=CC=C(C=C3)Br
Tpsa:
31.23
Logp:
4.2387
H Acceptors:
3
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: C₉H₁₀F₃N₃S
Molecular Weight: 249.26
Synonyms: 1-METHYL-N-[3-(TRIFLUOROMETHYL)PHENYL]-1-HYDRAZINECARBOTHIOAMIDE
SMILES: CN(C(=S)NC1=CC=CC(=C1)C(F)(F)F)N
Tpsa: 41.29
Logp: 2.2077
H Acceptors: 2
H Donors: 2
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:
C₉H₁₀F₃N₃S
Molecular Weight:
249.26
Synonyms:
1-METHYL-N-[3-(TRIFLUOROMETHYL)PHENYL]-1-HYDRAZINECARBOTHIOAMIDE
SMILES:
CN(C(=S)NC1=CC=CC(=C1)C(F)(F)F)N
Tpsa:
41.29
Logp:
2.2077
H Acceptors:
2
H Donors:
2
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: C₁₁H₁₀N₂S
Molecular Weight: 202.28
Synonyms: 6-(4-Methylphenyl)pyridazine-3-thiol
SMILES: CC1=CC=C(C=C1)C2=NNC(=S)C=C2
Tpsa: 28.68
Logp: 3.11461
H Acceptors: 2
H Donors: 1
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:
C₁₁H₁₀N₂S
Molecular Weight:
202.28
Synonyms:
6-(4-Methylphenyl)pyridazine-3-thiol
SMILES:
CC1=CC=C(C=C1)C2=NNC(=S)C=C2
Tpsa:
28.68
Logp:
3.11461
H Acceptors:
2
H Donors:
1
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: C₇H₅ClN₂S
Molecular Weight: 184.65
Synonyms: 5-Benzothiazolamine,4-chloro-(9CI)
SMILES: C1=CC2=C(C(=C1N)Cl)N=CS2
Tpsa: 38.91
Logp: 2.5319
H Acceptors: 3
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:
C₇H₅ClN₂S
Molecular Weight:
184.65
Synonyms:
5-Benzothiazolamine,4-chloro-(9CI)
SMILES:
C1=CC2=C(C(=C1N)Cl)N=CS2
Tpsa:
38.91
Logp:
2.5319
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0