Text Search
Structure Search

(1S,3S,4R,6S)-2-(tert-butoxycarbonyl)-6-hydroxy-2-azabicyclo[2.2.1]heptane-3-carboxylic acid

(1S,3S,4R,6S)-2-(tert-butoxycarbonyl)-6-hydroxy-2-azabicyclo[2.2.1]heptane-3-carboxylic acid

CAS: 1250884-25-3

Formula: C12H19NO5

SMILES: [H][C@]12C[C@H](O)[C@]([H])(C1)N([C@@H]2C(O)=O)C(=O)OC(C)(C)C

IUPAC: (1S,3S,4R,6S)-2-[(tert-butoxy)carbonyl]-6-hydroxy-2-azabicyclo[2.2.1]heptane-3-carboxylic acid

InChI: InChI=1S/C12H19NO5/c1-12(2,3)18-11(17)13-7-4-6(5-8(7)14)9(13)10(15)16/h6-9,14H,4-5H2,1-3H3,(H,15,16)/t6-,7+,8+,9+/m1/s1

Composition: C (56.02%), H (7.44%), N (5.44%), O (31.09%)

Molar Mass: 257.286

Atom Count: 37

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 4
Exact Mass 257.126322716
Formal Charge 0
FSP3 0.83
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey ARWLIMOJIMFGRX-XGEHTFHBSA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.43
Topological Polar Surface Area 87.07
Polarizability 24.55
Ring Count 2
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
LabNetwork INC
Purity LeadTime CAS PacketSize UnitPrice
95% 1 Day 1250884-25-3 $678.13-$2,535.62$678.13$1,267.81$2,535.62
Request Quote