AX24346
106920-25-6 | 1,3-Dithiole-2-thione, 4,5-bis(pentylthio)-
Manufacturer: A2B Chem
CAS Number: 106920-25-6
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Catalog Number
AX24346
Chemical Name
1,3-Dithiole-2-thione, 4,5-bis(pentylthio)-
Cas Number
106920-25-6
Molecular Formula
C13H22S5
Molecular Weight
338.6388
Mdl Number
MFCD00137893
Smiles
CCCCCSc1sc(=S)sc1SCCCCC
Complexity
259
Covalently-Bonded Unit Count
1
Heavy Atom Count
18
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
10
Xlogp3
7
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| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 4,5-Bis(pentylthio)-1,3-dithiole-2-thione | ChemScene | ₹ 3,08,187.12 |
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Catalog Number: AX24346
Chemical Name: 1,3-Dithiole-2-thione, 4,5-bis(pentylthio)-
Cas Number: 106920-25-6
Molecular Formula: C13H22S5
Molecular Weight: 338.6388
Mdl Number: MFCD00137893
Smiles: CCCCCSc1sc(=S)sc1SCCCCC
Complexity: 259
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 18
Hydrogen Bond Acceptor Count: 5
Rotatable Bond Count: 10
Xlogp3: 7
Catalog Number:
AX24346
Chemical Name:
1,3-Dithiole-2-thione, 4,5-bis(pentylthio)-
Cas Number:
106920-25-6
Molecular Formula:
C13H22S5
Molecular Weight:
338.6388
Mdl Number:
MFCD00137893
Smiles:
CCCCCSc1sc(=S)sc1SCCCCC
Complexity:
259
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
10
Xlogp3:
7
Catalog Number: AX24347
Chemical Name: 2-amino-5-bromo-3,4-dimethylbenzoic acid
Cas Number: 1194709-31-3
Molecular Formula: C9H10BrNO2
Molecular Weight: 244.0852
Mdl Number: MFCD31642450
Smiles: OC(=O)c1cc(Br)c(c(c1N)C)C
Complexity: 210
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 13
Hydrogen Bond Acceptor Count: 3
Rotatable Bond Count: 1
Xlogp3: 2.7
Catalog Number:
AX24347
Chemical Name:
2-amino-5-bromo-3,4-dimethylbenzoic acid
Cas Number:
1194709-31-3
Molecular Formula:
C9H10BrNO2
Molecular Weight:
244.0852
Mdl Number:
MFCD31642450
Smiles:
OC(=O)c1cc(Br)c(c(c1N)C)C
Complexity:
210
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Xlogp3:
2.7
Catalog Number: AX24348
Chemical Name: 1,2-Cyclopropanedicarboxylic acid, 3,3-dimethyl-, cis-
Cas Number: 936-87-8
Molecular Formula: C7H10O4
Molecular Weight: 158.1519
Mdl Number: MFCD05721474
Smiles: OC(=O)[C@@H]1[C@@H](C1(C)C)C(=O)O
Complexity: __
Covalently-Bonded Unit Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Rotatable Bond Count: __
Xlogp3: __
Catalog Number:
AX24348
Chemical Name:
1,2-Cyclopropanedicarboxylic acid, 3,3-dimethyl-, cis-
Cas Number:
936-87-8
Molecular Formula:
C7H10O4
Molecular Weight:
158.1519
Mdl Number:
MFCD05721474
Smiles:
OC(=O)[C@@H]1[C@@H](C1(C)C)C(=O)O
Complexity:
__
Covalently-Bonded Unit Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Rotatable Bond Count:
__
Xlogp3:
__
Catalog Number: AX24349
Chemical Name: 1-Piperazinecarboxylic acid, 4-[(4-nitrophenyl)acetyl]-, 1,1-dimethylethylester
Cas Number: 643087-38-1
Molecular Formula: C17H23N3O5
Molecular Weight: 349.3816
Mdl Number: MFCD31803577
Smiles: O=C(N1CCN(CC1)C(=O)OC(C)(C)C)Cc1ccc(cc1)[N+](=O)[O-]
Complexity: 495
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 25
Hydrogen Bond Acceptor Count: 5
Rotatable Bond Count: 4
Xlogp3: 1.8
Catalog Number:
AX24349
Chemical Name:
1-Piperazinecarboxylic acid, 4-[(4-nitrophenyl)acetyl]-, 1,1-dimethylethylester
Cas Number:
643087-38-1
Molecular Formula:
C17H23N3O5
Molecular Weight:
349.3816
Mdl Number:
MFCD31803577
Smiles:
O=C(N1CCN(CC1)C(=O)OC(C)(C)C)Cc1ccc(cc1)[N+](=O)[O-]
Complexity:
495
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Xlogp3:
1.8