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1219163-22-0 | Cyclopropanepropanoic acid, α-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-
CAS No: 1219163-22-0 Catalog No: AG0016E7 MDL No:MFCD06656852
Product Description
Catalog Number:
AG0016E7
Chemical Name:
Cyclopropanepropanoic acid, α-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-
CAS Number:
1219163-22-0
Molecular Formula:
C21H21NO4
Molecular Weight:
351.3957
MDL Number:
MFCD06656852
IUPAC Name:
3-cyclopropyl-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
InChI:
InChI=1S/C21H21NO4/c23-20(24)19(11-13-9-10-13)22-21(25)26-12-18-16-7-3-1-5-14(16)15-6-2-4-8-17(15)18/h1-8,13,18-19H,9-12H2,(H,22,25)(H,23,24)
InChI Key:
DRGUEWQZLABTFG-UHFFFAOYSA-N
SMILES:
O=C(NC(C(=O)O)CC1CC1)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
510
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.147g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
351.402g/mol
Monoisotopic Mass:
351.147g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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