AB69117
63980-69-8 | 5-Chloro-2-methoxyphenylthiourea
Manufacturer: A2B Chem
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CatalogNumber
AB69117
ChemicalName
5-Chloro-2-methoxyphenylthiourea
CasNumber
63980-69-8
MolecularFormula
C8H9ClN2OS
MolecularWeight
216.6879
MdlNumber
MFCD00041169
Smiles
COc1ccc(cc1NC(=S)N)Cl
NscNumber
25002
Complexity
191
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
2
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CatalogNumber: AB69117
ChemicalName: 5-Chloro-2-methoxyphenylthiourea
CasNumber: 63980-69-8
MolecularFormula: C8H9ClN2OS
MolecularWeight: 216.6879
MdlNumber: MFCD00041169
Smiles: COc1ccc(cc1NC(=S)N)Cl
NscNumber: 25002
Complexity: 191
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 2
CatalogNumber:
AB69117
ChemicalName:
5-Chloro-2-methoxyphenylthiourea
CasNumber:
63980-69-8
MolecularFormula:
C8H9ClN2OS
MolecularWeight:
216.6879
MdlNumber:
MFCD00041169
Smiles:
COc1ccc(cc1NC(=S)N)Cl
NscNumber:
25002
Complexity:
191
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1ccc(cn1)Cl
NscNumber: __
Complexity: 89.1
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.3
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1ccc(cn1)Cl
NscNumber:
__
Complexity:
89.1
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1ccc2c(c1)nc([nH]2)C
NscNumber: __
Complexity: 151
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2.7
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1ccc2c(c1)nc([nH]2)C
NscNumber:
__
Complexity:
151
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2.7
CatalogNumber: AB69120
ChemicalName: 5-Chloro-2-methyl-4-(trifluoromethyl)phenylboronic acid
CasNumber: 1072946-33-8
MolecularFormula: C8H7BClF3O2
MolecularWeight: 238.3992
MdlNumber: MFCD11053801
Smiles: OB(c1cc(Cl)c(cc1C)C(F)(F)F)O
NscNumber: __
Complexity: 224
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AB69120
ChemicalName:
5-Chloro-2-methyl-4-(trifluoromethyl)phenylboronic acid
CasNumber:
1072946-33-8
MolecularFormula:
C8H7BClF3O2
MolecularWeight:
238.3992
MdlNumber:
MFCD11053801
Smiles:
OB(c1cc(Cl)c(cc1C)C(F)(F)F)O
NscNumber:
__
Complexity:
224
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
__