1H-Indole-3-carbohydrazide

CAT: 0127-OR110382-01Size: 5 gDry Ice: NoHazardous: No

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CAT#:0127-OR110382-01Size:5 g

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CAS Number

15317-58-5

MDL Number

MFCD00464063

Purity

98%

Smiles

NNC(=O)c1c[nH]c2ccccc12

Chemical Information

1H-indole-3-carbohydrazide

CAS Number	15317-58-5
PubChem CID	27199
IUPAC Name	1H-indole-3-carbohydrazide
Molecular Formula	C9H9N3O
Molecular Weight	175.19
XLogP	1
Topological Polar Surface Area	70.9
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	13
Formal Charge	0
Complexity	207

SMILES

C1=CC=C2C(=C1)C(=CN2)C(=O)NN

InChI

InChI=1S/C9H9N3O/c10-12-9(13)7-5-11-8-4-2-1-3-6(7)8/h1-5,11H,10H2,(H,12,13)

InChIKey

QHUYDKZSGDJDSC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 15317-58-5

CID: 27199

Formula: C9H9N3O

MW: 175.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	175.19
XLogP3	1
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	175.074561919
Monoisotopic Mass	175.074561919
Topological Polar Surface Area	70.9 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	207
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR7963	1H-Indole-2-carbohydrazide
OR305214	1H-Indole-5-carbohydrazide
OR28978	1H-Indole-7-carbohydrazide
OR305209-01	1H-Indole-4-carbohydrazide
OR305234	1H-Indole-6-carbohydrazide
OR110212	3-Iodo-1H-indole-2-carbohydrazide
OR15075	3-Chloro-1H-indole-2-carbohydrazide
OR15068-01	3-Bromo-1H-indole-2-carbohydrazide
OR110064	5-Bromo-1H-indole-2-carbohydrazide
PC300989-01	5- (Trifluoromethoxy) -1H-indole-2-carbohydrazide

Catalog	Name
JH638598	1H-Indole-3-carbohydrazide
sc-259001	1H-Indole-7-carbohydrazide
sc-297984	1H-Indole-2-carbohydrazide
BJB21174-01	1H-Indole-6-carbohydrazide
sc-299104A	3-Phenyl-1H-indole-2-carbohydrazide
sc-312616A	3-Chloro-1H-indole-2-carbohydrazide
sc-312529A	3-Bromo-1H-indole-2-carbohydrazide
BAA99783-01	5-Fluoro-1H-indole-3-carbohydrazide
FM114293-01	1-Methyl-1H-indole-3-carbohydrazide
sc-298883A	3-Amino-1H-indole-2-carbohydrazide