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103500-22-7 | Benzyl (1-(hydroxymethyl)cyclopropyl)carbamate
CAS No: 103500-22-7 Catalog No: AG0038CU MDL No:MFCD16294221
Product Description
Catalog Number:
AG0038CU
Chemical Name:
Benzyl (1-(hydroxymethyl)cyclopropyl)carbamate
CAS Number:
103500-22-7
Molecular Formula:
C12H15NO3
Molecular Weight:
221.2524
MDL Number:
MFCD16294221
IUPAC Name:
benzyl N-[1-(hydroxymethyl)cyclopropyl]carbamate
InChI:
InChI=1S/C12H15NO3/c14-9-12(6-7-12)13-11(15)16-8-10-4-2-1-3-5-10/h1-5,14H,6-9H2,(H,13,15)
InChI Key:
VAZQQRNYILEOGE-UHFFFAOYSA-N
SMILES:
OCC1(CC1)NC(=O)OCc1ccccc1
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.105g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
221.256g/mol
Monoisotopic Mass:
221.105g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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