Text Search
Structure Search

tert-butyl N-[(1R,2S)-2-(4-bromophenyl)cyclopropyl]carbamate

tert-butyl N-[(1R,2S)-2-(4-bromophenyl)cyclopropyl]carbamate

CAS: 907196-12-7

Formula: C14H18BrNO2

SMILES: CC(C)(C)OC(=O)N[C@@H]1C[C@H]1C1=CC=C(Br)C=C1

IUPAC: tert-butyl N-[(1R,2S)-2-(4-bromophenyl)cyclopropyl]carbamate

InChI: InChI=1S/C14H18BrNO2/c1-14(2,3)18-13(17)16-12-8-11(12)9-4-6-10(15)7-5-9/h4-7,11-12H,8H2,1-3H3,(H,16,17)/t11-,12+/m0/s1

Composition: C (53.86%), H (5.81%), Br (25.59%), N (4.49%), O (10.25%)

Molar Mass: 312.207

Atom Count: 36

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 2
Exact Mass 311.052092
Formal Charge 0
FSP3 0.5
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey ATYDSIJHMSGNKM-NWDGAFQWSA-N
Lipinski's Rule of Five 1
Molar Refractivity 74.19
Topological Polar Surface Area 38.33
Polarizability 29.01
Ring Count 2
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
J&W PHARMLAB LLC
Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 907196-12-7 $457.70-$9,197.70$457.70$687.70$977.50$1,587.00$2,297.70$9,197.70
Request Quote