AX29030
939758-88-0 | 2H-1-Benzopyran-8-carboxylic acid, 3-amino-3,4-dihydro-, methyl ester
Manufacturer: A2B Chem
CAS Number: 939758-88-0
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Catalog Number
AX29030
Chemical Name
2H-1-Benzopyran-8-carboxylic acid, 3-amino-3,4-dihydro-, methyl ester
Cas Number
939758-88-0
Molecular Formula
C11H13NO3
Molecular Weight
207.2258
Mdl Number
MFCD08544309
Smiles
COC(=O)c1cccc2c1OCC(C2)N
Complexity
244
Covalently-Bonded Unit Count
1
Heavy Atom Count
15
Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
1
Rotatable Bond Count
2
Undefined Atom Stereocenter Count
1
Xlogp3
0.9
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Catalog Number: AX29030
Chemical Name: 2H-1-Benzopyran-8-carboxylic acid, 3-amino-3,4-dihydro-, methyl ester
Cas Number: 939758-88-0
Molecular Formula: C11H13NO3
Molecular Weight: 207.2258
Mdl Number: MFCD08544309
Smiles: COC(=O)c1cccc2c1OCC(C2)N
Complexity: 244
Covalently-Bonded Unit Count: 1
Heavy Atom Count: 15
Hydrogen Bond Acceptor Count: 4
Hydrogen Bond Donor Count: 1
Rotatable Bond Count: 2
Undefined Atom Stereocenter Count: 1
Xlogp3: 0.9
Catalog Number:
AX29030
Chemical Name:
2H-1-Benzopyran-8-carboxylic acid, 3-amino-3,4-dihydro-, methyl ester
Cas Number:
939758-88-0
Molecular Formula:
C11H13NO3
Molecular Weight:
207.2258
Mdl Number:
MFCD08544309
Smiles:
COC(=O)c1cccc2c1OCC(C2)N
Complexity:
244
Covalently-Bonded Unit Count:
1
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Rotatable Bond Count:
2
Undefined Atom Stereocenter Count:
1
Xlogp3:
0.9
Catalog Number: AX29038
Chemical Name: 6,7-Dihydro-5h-pyrrolo[1,2-a]imidazol-3-ylmethanol
Cas Number: 1044764-19-3
Molecular Formula: C7H10N2O
Molecular Weight: 138.1671
Mdl Number: MFCD08751339
Smiles: OCc1cnc2n1CCC2
Complexity: __
Covalently-Bonded Unit Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Hydrogen Bond Donor Count: __
Rotatable Bond Count: __
Undefined Atom Stereocenter Count: __
Xlogp3: __
Catalog Number:
AX29038
Chemical Name:
6,7-Dihydro-5h-pyrrolo[1,2-a]imidazol-3-ylmethanol
Cas Number:
1044764-19-3
Molecular Formula:
C7H10N2O
Molecular Weight:
138.1671
Mdl Number:
MFCD08751339
Smiles:
OCc1cnc2n1CCC2
Complexity:
__
Covalently-Bonded Unit Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
__
Undefined Atom Stereocenter Count:
__
Xlogp3:
__
Catalog Number: AX29039
Chemical Name: 5-Bromo-4-chloro-2-isopropylpyrimidine
Cas Number: 1044767-89-6
Molecular Formula: C7H8BrClN2
Molecular Weight: 235.5088
Mdl Number: MFCD11046968
Smiles: CC(c1ncc(c(n1)Cl)Br)C
Complexity: __
Covalently-Bonded Unit Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Hydrogen Bond Donor Count: __
Rotatable Bond Count: __
Undefined Atom Stereocenter Count: __
Xlogp3: __
Catalog Number:
AX29039
Chemical Name:
5-Bromo-4-chloro-2-isopropylpyrimidine
Cas Number:
1044767-89-6
Molecular Formula:
C7H8BrClN2
Molecular Weight:
235.5088
Mdl Number:
MFCD11046968
Smiles:
CC(c1ncc(c(n1)Cl)Br)C
Complexity:
__
Covalently-Bonded Unit Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
__
Undefined Atom Stereocenter Count:
__
Xlogp3:
__
Catalog Number: AX29040
Chemical Name: 7-Bromo-1-ethyl-1H-imidazo[4,5-c]pyridine
Cas Number: 1044771-89-2
Molecular Formula: C8H8BrN3
Molecular Weight: 226.0732
Mdl Number: MFCD11046873
Smiles: CCn1cnc2c1c(Br)cnc2
Complexity: __
Covalently-Bonded Unit Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Hydrogen Bond Donor Count: __
Rotatable Bond Count: __
Undefined Atom Stereocenter Count: __
Xlogp3: __
Catalog Number:
AX29040
Chemical Name:
7-Bromo-1-ethyl-1H-imidazo[4,5-c]pyridine
Cas Number:
1044771-89-2
Molecular Formula:
C8H8BrN3
Molecular Weight:
226.0732
Mdl Number:
MFCD11046873
Smiles:
CCn1cnc2c1c(Br)cnc2
Complexity:
__
Covalently-Bonded Unit Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Hydrogen Bond Donor Count:
__
Rotatable Bond Count:
__
Undefined Atom Stereocenter Count:
__
Xlogp3:
__