Name: Name:2,3-dimethyl rac-(1R,2R,3S,4S)-7-azabicyclo[2.2.1]heptane-2,3-dicarboxylate
Brand: Angene
SKU: AG01EJ9W
Rating: 90 (10 reviews)

2,3-dimethyl rac-(1R,2R,3S,4S)-7-azabicyclo[2.2.1]heptane-2,3-dicarboxylate

CAS No.:

378245-84-2

Catalog Number:

AG01EJ9W

Molecular Formula:

C10H15NO4

Molecular Weight:

213.2304

Catalog Number:

AG01EJ9W

Chemical Name:

2,3-dimethyl rac-(1R,2R,3S,4S)-7-azabicyclo[2.2.1]heptane-2,3-dicarboxylate

CAS Number:

378245-84-2

Molecular Formula:

C10H15NO4

Molecular Weight:

213.2304

MDL Number:

MFCD31616697

IUPAC Name:

dimethyl (1S,4R)-7-azabicyclo[2.2.1]heptane-2,3-dicarboxylate

InChI:

InChI=1S/C10H15NO4/c1-14-9(12)7-5-3-4-6(11-5)8(7)10(13)15-2/h5-8,11H,3-4H2,1-2H3/t5-,6+,7?,8?

InChI Key:

HLVPBIOZQSLXMN-XEDAXZNXSA-N

SMILES:

COC(=O)[C@@H]1[C@@H]2CC[C@H]([C@@H]1C(=O)OC)N2

Complexity:

263

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

213.1g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

213.233g/mol

Monoisotopic Mass:

213.1g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

64.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.1