Name: Name:2-[5-(propan-2-yl)-1H-1,2,3,4-tetrazol-1-yl]acetic acid
Brand: Angene
SKU: AG019TBR
Rating: 90 (10 reviews)

2-[5-(propan-2-yl)-1H-1,2,3,4-tetrazol-1-yl]acetic acid

CAS No.:

1267751-57-4

Catalog Number:

AG019TBR

Molecular Formula:

C6H10N4O2

Molecular Weight:

170.1692

Catalog Number:

AG019TBR

Chemical Name:

2-[5-(propan-2-yl)-1H-1,2,3,4-tetrazol-1-yl]acetic acid

CAS Number:

1267751-57-4

Molecular Formula:

C6H10N4O2

Molecular Weight:

170.1692

MDL Number:

MFCD19282236

IUPAC Name:

2-(5-propan-2-yltetrazol-1-yl)acetic acid

InChI:

InChI=1S/C6H10N4O2/c1-4(2)6-7-8-9-10(6)3-5(11)12/h4H,3H2,1-2H3,(H,11,12)

InChI Key:

XJDCALQXLFYKNE-UHFFFAOYSA-N

SMILES:

OC(=O)Cn1nnnc1C(C)C

Complexity:

173

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

170.08g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

170.172g/mol

Monoisotopic Mass:

170.08g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.4