200,000+ products from a single source!
sales@angenechem.com
113906-00-6 | Hydrazinecarboxylic acid, 2-[(1-methyl-1H-pyrrol-2-yl)methylene]-, phenylmethyl ester
CAS No: 113906-00-6 Catalog No: AG000A1M MDL No:
Product Description
Catalog Number:
AG000A1M
Chemical Name:
Hydrazinecarboxylic acid, 2-[(1-methyl-1H-pyrrol-2-yl)methylene]-, phenylmethyl ester
CAS Number:
113906-00-6
Molecular Formula:
C14H15N3O2
Molecular Weight:
257.2878
IUPAC Name:
benzyl N-[(1-methylpyrrol-2-yl)methylideneamino]carbamate
InChI:
InChI=1S/C14H15N3O2/c1-17-9-5-8-13(17)10-15-16-14(18)19-11-12-6-3-2-4-7-12/h2-10H,11H2,1H3,(H,16,18)
InChI Key:
YQTPAHFGROLFJF-UHFFFAOYSA-N
SMILES:
O=C(OCc1ccccc1)NN=Cc1cccn1C
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.116g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
257.293g/mol
Monoisotopic Mass:
257.116g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.