AI46016
2590-41-2 | Estra-4,6-dien-3-one, 17-(acetyloxy)-, (17b)-
Manufacturer: A2B Chem
CAS Number: 2590-41-2
The price for this product is unavailable. Please request a quote
Catalog Number
AI46016
Chemical Name
Estra-4,6-dien-3-one, 17-(acetyloxy)-, (17b)-
Cas Number
2590-41-2
Molecular Formula
C20H26O3
Molecular Weight
314.4186
Mdl Number
MFCD00271529
Smiles
CC(=O)O[C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2C=CC2=CC(=O)CC[C@H]12
Complexity
602
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
6
Heavy Atom Count
23
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
2
Xlogp3
3.1
Compare Similar Items
Show Difference
Catalog Number: AI46016
Chemical Name: Estra-4,6-dien-3-one, 17-(acetyloxy)-, (17b)-
Cas Number: 2590-41-2
Molecular Formula: C20H26O3
Molecular Weight: 314.4186
Mdl Number: MFCD00271529
Smiles: CC(=O)O[C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2C=CC2=CC(=O)CC[C@H]12
Complexity: 602
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 6
Heavy Atom Count: 23
Hydrogen Bond Acceptor Count: 3
Rotatable Bond Count: 2
Xlogp3: 3.1
Catalog Number:
AI46016
Chemical Name:
Estra-4,6-dien-3-one, 17-(acetyloxy)-, (17b)-
Cas Number:
2590-41-2
Molecular Formula:
C20H26O3
Molecular Weight:
314.4186
Mdl Number:
MFCD00271529
Smiles:
CC(=O)O[C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2C=CC2=CC(=O)CC[C@H]12
Complexity:
602
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
6
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Xlogp3:
3.1
Catalog Number: AI46017
Chemical Name: Ethyl 4-bromo-5-methyl-1h-pyrrole-2-carboxylate
Cas Number: 25907-29-3
Molecular Formula: C8H10BrNO2
Molecular Weight: 232.0745
Mdl Number: MFCD22581480
Smiles: CCOC(=O)c1cc(c([nH]1)C)Br
Complexity: __
Covalently-Bonded Unit Count: __
Defined Atom Stereocenter Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Rotatable Bond Count: __
Xlogp3: __
Catalog Number:
AI46017
Chemical Name:
Ethyl 4-bromo-5-methyl-1h-pyrrole-2-carboxylate
Cas Number:
25907-29-3
Molecular Formula:
C8H10BrNO2
Molecular Weight:
232.0745
Mdl Number:
MFCD22581480
Smiles:
CCOC(=O)c1cc(c([nH]1)C)Br
Complexity:
__
Covalently-Bonded Unit Count:
__
Defined Atom Stereocenter Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Rotatable Bond Count:
__
Xlogp3:
__
Catalog Number: AI46018
Chemical Name: 1-(tert-Butoxycarbonyl)-1,4,5,6-tetrahydropyridine-2-carboxylic acid
Cas Number: 259133-67-0
Molecular Formula: C11H17NO4
Molecular Weight: 227.257
Mdl Number: MFCD20039714
Smiles: O=C(N1CCCC=C1C(=O)O)OC(C)(C)C
Complexity: __
Covalently-Bonded Unit Count: __
Defined Atom Stereocenter Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Rotatable Bond Count: __
Xlogp3: __
Catalog Number:
AI46018
Chemical Name:
1-(tert-Butoxycarbonyl)-1,4,5,6-tetrahydropyridine-2-carboxylic acid
Cas Number:
259133-67-0
Molecular Formula:
C11H17NO4
Molecular Weight:
227.257
Mdl Number:
MFCD20039714
Smiles:
O=C(N1CCCC=C1C(=O)O)OC(C)(C)C
Complexity:
__
Covalently-Bonded Unit Count:
__
Defined Atom Stereocenter Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Rotatable Bond Count:
__
Xlogp3:
__
Catalog Number: AI46019
Chemical Name: Ethyl (4-amino-3-nitrophenyl)carbamate
Cas Number: 25917-87-7
Molecular Formula: C9H11N3O4
Molecular Weight: 225.2013
Mdl Number: MFCD05859193
Smiles: CCOC(=O)Nc1ccc(c(c1)[N+](=O)[O-])N
Complexity: __
Covalently-Bonded Unit Count: __
Defined Atom Stereocenter Count: __
Heavy Atom Count: __
Hydrogen Bond Acceptor Count: __
Rotatable Bond Count: __
Xlogp3: __
Catalog Number:
AI46019
Chemical Name:
Ethyl (4-amino-3-nitrophenyl)carbamate
Cas Number:
25917-87-7
Molecular Formula:
C9H11N3O4
Molecular Weight:
225.2013
Mdl Number:
MFCD05859193
Smiles:
CCOC(=O)Nc1ccc(c(c1)[N+](=O)[O-])N
Complexity:
__
Covalently-Bonded Unit Count:
__
Defined Atom Stereocenter Count:
__
Heavy Atom Count:
__
Hydrogen Bond Acceptor Count:
__
Rotatable Bond Count:
__
Xlogp3:
__